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pre-ELM-11IUPAC Name: copper;2-pyridin-2-ylpyridine;ditetrafluoroborate;dihydrateSMILES: [B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.O.O.[Cu+2]InChIKey: OLBITSHZKINIHL-UHFFFAOYSA-NInChI: InChI=1S/2C10H8N2.2BF4.Cu.2H2O/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*2-1(3,4)5;;;/h2*1-8H;;;;2*1H2/q;;2*-1;+2;;Synonyms: copper;2-pyridin-2-ylpyridine;ditetrafluoroborate;dihydrate | D89511 | pre-ELM-11
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5-Diethylamino-2-nitrosophenol HydrochlorideCas Number: 25953-06-4Formula: C10H14N2O2·HCl Molecular Weight: 230.69IUPAC Name: 5-(diethylamino)-2-nitrosophenol;hydrochlorideSMILES: CCN(CC)C1=CC(=C(C=C1)N=O)O.ClInChIKey: JFOYWYLGEUIHOJ-UHFFFAOYSA-NInChI: InChI=1S/C10H14N2O2.ClH/c1-3-12(4-2)8-5-6-9(11-14)10(13)7-8;/h5-7,13H,3-4H2,1-2H3;1HSynonyms: 25953-06-4|5-(Diethylamino)-2-nitrosophenol hydrochloride|5-DIETHYLAMINO-2-NITROSOPHENOL HYDROCHLORIDE|2-NITROSO-5-DI...
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D-(-)-threo-2-Amino-1-(4-nitrophenyl)-1,3-propanediolCas Number: 716-61-0Formula: C9H12N2O4 Molecular Weight: 212.21IUPAC Name: (1R,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diolSMILES: C1=CC(=CC=C1C(C(CO)N)O)[N+](=O)[O-]InChIKey: OCYJXSUPZMNXEN-RKDXNWHRSA-NInChI: InChI=1S/C9H12N2O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-4,8-9,12-13H,5,10H2/t8-,9-/m1/s1Synonyms: AC-11827 | (R,R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol | trans-2-Amino-1-(4-nitrophenyl)propane-1,3-diol | AKOS00...
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Ethyl 2-PyridyldithiocarbamateCas Number: 13037-05-3Formula: C8H10N2S2 Molecular Weight: 198.3IUPAC Name: ethyl N-pyridin-2-ylcarbamodithioateSMILES: CCSC(=S)NC1=CC=CC=N1InChIKey: ZCXHKAIAVJUBPJ-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2S2/c1-2-12-8(11)10-7-5-3-4-6-9-7/h3-6H,2H2,1H3,(H,9,10,11)Synonyms: 13037-05-3|Ethyl 2-Pyridyldithiocarbamate|2-Pyridyldithiocarbamic Acid Ethyl Ester|ethyl pyridin-2-ylcarbamodithioate...
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(S)-3,3,3-Trifluoro-2-hydroxy-2-methylpropionic AcidCas Number: 24435-45-8Formula: C4H5F3O3 Molecular Weight: 158.08IUPAC Name: (2S)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acidSMILES: CC(C(=O)O)(C(F)(F)F)OInChIKey: CTGJACFEVDCYMC-VKHMYHEASA-NInChI: InChI=1S/C4H5F3O3/c1-3(10,2(8)9)4(5,6)7/h10H,1H3,(H,8,9)/t3-/m0/s1Synonyms: Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-methyl-, (2S) | Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-methyl-, (2S)...
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2-Methyl-6-nitrobenzoyl ChlorideCas Number: 66232-57-3Formula: C8H6ClNO3 Molecular Weight: 199.59IUPAC Name: 2-methyl-6-nitrobenzoyl chlorideSMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)ClInChIKey: ZMAJSTDJAIVHGZ-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClNO3/c1-5-3-2-4-6(10(12)13)7(5)8(9)11/h2-4H,1H3Synonyms: 2-Methyl-6-nitrobenzoyl Chloride|66232-57-3|2-Methyl-6-nitrobenzoylchloride|6-Nitro-o-toluoyl Chloride|SCHEMBL6655711...
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(-)-Diacetyl-D-tartaric AnhydrideCas Number: 70728-23-3Formula: C8H8O7 Molecular Weight: 216.15IUPAC Name: [(3S,4S)-4-acetyloxy-2,5-dioxooxolan-3-yl] acetateSMILES: CC(=O)OC1C(C(=O)OC1=O)OC(=O)CInChIKey: XAKITKDHDMPGPW-WDSKDSINSA-NInChI: InChI=1S/C8H8O7/c1-3(9)13-5-6(14-4(2)10)8(12)15-7(5)11/h5-6H,1-2H3/t5-,6-/m0/s1Synonyms: acetic acid (3S,4S)-4-acetoxy-2,5-dioxo-tetrahydro-furan-3-yl ester | Di-O-acetyl-D-tartaric Anhydride | (-)-Diacetyl...
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(R)-2-Chlorobutyric AcidCas Number: 54053-45-1Formula: C4H7ClO2 Molecular Weight: 122.55IUPAC Name: (2R)-2-chlorobutanoic acidSMILES: CCC(C(=O)O)ClInChIKey: RVBUZBPJAGZHSQ-GSVOUGTGSA-NInChI: InChI=1S/C4H7ClO2/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H,6,7)/t3-/m1/s1Synonyms: (R)-(+)-2-Chlorobutanoic acid | (r)-2-chlorobutanoic acid | C2109 | AKOS015848429 | BS-43995 | (R)-2-Chlorobutyric Ac...
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1-Ethyl-1-(o-tolyl)hydrazineCas Number: 910041-10-0Formula: C9H14N2 Molecular Weight: 150.23IUPAC Name: 1-ethyl-1-(2-methylphenyl)hydrazineSMILES: CCN(C1=CC=CC=C1C)NInChIKey: FGGBNBLMSDRPEA-UHFFFAOYSA-NInChI: InChI=1S/C9H14N2/c1-3-11(10)9-7-5-4-6-8(9)2/h4-7H,3,10H2,1-2H3Synonyms: 1-Ethyl-1-(o-tolyl)hydrazine|910041-10-0|1-ethyl-1-(2-methylphenyl)hydrazine|SCHEMBL3518892|DTXSID20575326|MFCD038447...
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3-Amino-4-hydroxy-5-nitrobenzenesulfonic AcidCas Number: 96-93-5Formula: C6H6N2O6S Molecular Weight: 234.18IUPAC Name: 3-amino-4-hydroxy-5-nitrobenzenesulfonic acidSMILES: C1=C(C=C(C(=C1N)O)[N+](=O)[O-])S(=O)(=O)OInChIKey: RHPXYZMDLOJTFF-UHFFFAOYSA-NInChI: InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)Synonyms: 2-AMINO-6-NITRO-1-PHENOL-4-SULFONIC ACID | AKOS001021935 | Benzenesulfonic acid, 3-amino-4-hydroxy-5-nitro- | Z567542...
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(+)-3-Bromocamphor-8-sulfonic Acid Ammonium SaltCas Number: 14575-84-9 Compound CID: 11759249Formula: C10H18BrNO4S Molecular Weight: 328.22IUPAC Name: azanium;[(1R,3S,4S,7R)-3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl]methanesulfonateSMILES: CC12CCC(C1(C)CS(=O)(=O)[O-])C(C2=O)Br.[NH4+]InChIKey: GFBVBBRNPGPROZ-ZEMXJPTRSA-NInChI: InChI=1S/C10H15BrO4S.H3N/c1-9-4-3-6(7(11)8(9)12)10(9,2)5-16(13,14)15;/h6-7H,3-5H2,1-2H3,(H,13,14,15);1H3/t6-,7+,9+,10-;/m1./s1Synonyms: AKOS016843499 | Ammonium ((1R,3S,4S,7R)-3-bromo-1,7-dimethyl-2-oxobicyclo[2.2.1]heptan-7-yl)methanesulfonate | C10H18...
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Diethylamine HydrobromideCas Number: 6274-12-0Formula: C4H11N·HBr Molecular Weight: 154.05IUPAC Name: N-ethylethanamine;hydrobromideSMILES: CCNCC.BrInChIKey: AATGHKSFEUVOPF-UHFFFAOYSA-NInChI: InChI=1S/C4H11N.BrH/c1-3-5-4-2;/h5H,3-4H2,1-2H3;1HSynonyms: MFCD00012498 | SB75722 | N-Ethylethanamine;hydrobromide | DTXSID80878709 | NSC35762 | NSC-35762 | A833965 | Diethylam...