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Monoterpenoids
Description:
Compounds containing a chain of two isoprene units.
Ancestors:
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(R)-BoroPro-(+)-Pinanediol-hydrochlorideCas Number: 147208-69-3 EC Number: 604-578-0IUPAC Name: (2R)-2-[(1S,2S,6R,8S)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]pyrrolidine;hydrochlorideSMILES: B1(OC2CC3CC(C3(C)C)C2(O1)C)C4CCCN4.ClInChIKey: OVVMNBVQOPZMPY-AKDYBRCWSA-NInChI: InChI=1S/C14H24BNO2.ClH/c1-13(2)9-7-10(13)14(3)11(8-9)17-15(18-14)12-5-4-6-16-12;/h9-12,16H,4-8H2,1-3H3;1H/t9-,10-,11+,12-,14-;/m0./s1 -
(E)-3，7-dimethylocta-2，6-dien-1-yl benzoateCas Number: 94-48-4 Compound CID: 5353011Formula: C9H13N Molecular Weight: 135.21IUPAC Name: [(2E)-3,7-dimethylocta-2,6-dienyl] benzoateSMILES: CC(=CCCC(=CCOC(=O)C1=CC=CC=C1)C)CInChIKey: YDVXYTIIPGKIJP-NTCAYCPXSA-NInChI: InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+
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(3aS，4S，6S，7aR)-2-Isobutyl-3a，5，5-trimethylhexahydro-4，6-methanobenzo[d][1，3，2]dioxaboroleCas Number: 84110-34-9 Compound CID: 12842239Formula: C14H25BO2 Molecular Weight: 236.17IUPAC Name: (1S,2S,6R,8S)-2,9,9-trimethyl-4-(2-methylpropyl)-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decaneSMILES: B1(OC2CC3CC(C3(C)C)C2(O1)C)CC(C)CInChIKey: QGWQMLAZUPRXGK-FMSGJZPZSA-NInChI: InChI=1S/C14H25BO2/c1-9(2)8-15-16-12-7-10-6-11(13(10,3)4)14(12,5)17-15/h9-12H,6-8H2,1-5H3/t10-,11-,12+,14-/m0/s1
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(2R，5R)-(1R，2S，5R)-2-Isopropyl-5-methylcyclohexyl 5-hydroxy-1，3-oxathiolane-2-carboxylateFormula: C14H24O4S Molecular Weight: 288.4IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2R,5R)-5-hydroxy-1,3-oxathiolane-2-carboxylateSMILES: CC1CCC(C(C1)OC(=O)C2OC(CS2)O)C(C)CInChIKey: KXKDZLRTIFHOHW-CYRBOEJBSA-NInChI: InChI=1S/C14H24O4S/c1-8(2)10-5-4-9(3)6-11(10)17-13(16)14-18-12(15)7-19-14/h8-12,14-15H,4-7H2,1-3H3/t9-,10+,11-,12-,14-/m1/s1
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trans-β-OcimeneCas Number: 3779-61-1Formula: C10H16 Molecular Weight: 136.23IUPAC Name: (3E)-3,7-dimethylocta-1,3,6-trieneSMILES: CC(=CCC=C(C)C=C)CInChIKey: IHPKGUQCSIINRJ-CSKARUKUSA-NInChI: InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3/b10-8+
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Carvacrol methyl etherCas Number: 6379-73-3 EC Number: 228-959-2Formula: C11H16O Molecular Weight: 164.24IUPAC Name: 2-methoxy-1-methyl-4-propan-2-ylbenzeneSMILES: CC1=C(C=C(C=C1)C(C)C)OCInChIKey: YVLHTQPPMZOCOW-UHFFFAOYSA-NInChI: InChI=1S/C11H16O/c1-8(2)10-6-5-9(3)11(7-10)12-4/h5-8H,1-4H3Synonyms: 4-Isopropyl-2-methoxy-1-methylbenzene | 2-Methoxy-1-methyl-4-(propan-2-yl)benzene | Methylcarvacrol
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para-menthaneCas Number: 99-82-1Formula: C10H20 Molecular Weight: 140.27IUPAC Name: 1-methyl-4-propan-2-ylcyclohexaneSMILES: CC1CCC(CC1)C(C)CInChIKey: CFJYNSNXFXLKNS-UHFFFAOYSA-NInChI: InChI=1S/C10H20/c1-8(2)10-6-4-9(3)5-7-10/h8-10H,4-7H2,1-3H3
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TricycleneCas Number: 508-32-7 Compound CID: 79035Formula: C10H16 Molecular Weight: 136.23IUPAC Name: 1,7,7-trimethyltricyclo[2.2.1.02,6]heptaneSMILES: CC1(C2CC3C1(C3C2)C)CInChIKey: RRBYUSWBLVXTQN-UHFFFAOYSA-NInChI: InChI=1S/C10H16/c1-9(2)6-4-7-8(5-6)10(7,9)3/h6-8H,4-5H2,1-3H3
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Menthyl isovalerateCas Number: 16409-46-4 Compound CID: 565690Formula: C15H28O2 Molecular Weight: 240.38IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 3-methylbutanoateSMILES: CC1CCC(C(C1)OC(=O)CC(C)C)C(C)CInChIKey: VYQSSWZYPCCBRN-UHFFFAOYSA-NInChI: InChI=1S/C15H28O2/c1-10(2)8-15(16)17-14-9-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3
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LINALYL ISOBUTYRATECas Number: 78-35-3 Compound CID: 6532Formula: C14H24O2 Molecular Weight: 224.34IUPAC Name: 3,7-dimethylocta-1,6-dien-3-yl 2-methylpropanoateSMILES: CC(C)C(=O)OC(C)(CCC=C(C)C)C=CInChIKey: JZIARAQCPRDGAC-UHFFFAOYSA-NInChI: InChI=1S/C14H24O2/c1-7-14(6,10-8-9-11(2)3)16-13(15)12(4)5/h7,9,12H,1,8,10H2,2-6H3
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3-(Chlorosulfonyl)-4-isopropylbenzoic acidCas Number: 59815-29-1 Compound CID: 309510Formula: C10H11ClO4S Molecular Weight: 262.7IUPAC Name: 3-chlorosulfonyl-4-propan-2-ylbenzoic acidSMILES: CC(C)C1=C(C=C(C=C1)C(=O)O)S(=O)(=O)ClInChIKey: KSRCCOHUNHPILB-UHFFFAOYSA-NInChI: InChI=1S/C10H11ClO4S/c1-6(2)8-4-3-7(10(12)13)5-9(8)16(11,14)15/h3-6H,1-2H3,(H,12,13)
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2，2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarbohydrazideCas Number: 113904-76-0 Compound CID: 3866001Formula: C10H18N2O Molecular Weight: 182.26IUPAC Name: 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbohydrazideSMILES: CC(=CC1C(C1(C)C)C(=O)NN)CInChIKey: ONNOJEVCFHFAQR-UHFFFAOYSA-NInChI: InChI=1S/C10H18N2O/c1-6(2)5-7-8(9(13)12-11)10(7,3)4/h5,7-8H,11H2,1-4H3,(H,12,13)
