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Methyl 9 - (m-isopropylphenyl) - 2,6 - dimethyl - cis - 6 - nonen - oate
SpectraBase Compound ID E9ACQlx7vc6
InChI InChI=1S/C21H32O2/c1-16(2)20-14-8-13-19(15-20)12-7-10-17(3)9-6-11-18(4)21(22)23-5/h8,10,13-16,18H,6-7,9,11-12H2,1-5H3/b17-10-
InChIKey APIXIQCPPJEJKT-YVLHZVERSA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EhbzZjAfp17
Name Methyl 9 - (m-isopropylphenyl) - 2,6 - dimethyl - cis - 6 - nonen - oate
CAS Registry Number 17397-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-16(2)20-14-8-13-19(15-20)12-7-10-17(3)9-6-11-18(4)21(22)23-5/h8,10,13-16,18H,6-7,9,11-12H2,1-5H3/b17-10-
InChIKey APIXIQCPPJEJKT-YVLHZVERSA-N
Molecular Weight 316.485 g/mol
SMILES C(=O)(C(CCC\C(=C/CCc1cc(C(C)C)ccc1)C)C)OC
SPLASH splash10-000w-8900000000-7b8af996175330a357f3
Source of Spectrum Va-0-0-0
Synonyms (Z)-(+)-9-m-cumenyl-2,6-dimethyl-6-nonenoic acid, methyl ester Methyl 9-(3-isopropylphenyl)-2,6-dimethyl-6(Z)-nonen-oate Methyl (6Z)-9-(3-isopropylphenyl)-2,6-dimethyl-6-nonenoate Methyl 9-(3-isopropylphenyl)-2,6-dimethyl-cis-6-nonen-oate
Wiley ID 740614