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(E,1RS,3S)-Acetic acid 3-Isopropyl-1-methyl-3-phenyl-4-hexenyl ester
SpectraBase Compound ID 7EfTAbCOwrU
InChI InChI=1S/C18H26O2/c1-6-12-18(14(2)3,13-15(4)20-16(5)19)17-10-8-7-9-11-17/h6-12,14-15H,13H2,1-5H3/b12-6+/t15?,18-/m0/s1
InChIKey IPKBXKLILHBHIZ-GJBGCBHJSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bz8UrKRQ6jW
Name (E,1RS,3S)-Acetic acid 3-Isopropyl-1-methyl-3-phenyl-4-hexenyl ester
Alternate Name(s) (3S,4E)-3-isopropyl-1-methyl-3-phenyl-4-hexenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-6-12-18(14(2)3,13-15(4)20-16(5)19)17-10-8-7-9-11-17/h6-12,14-15H,13H2,1-5H3/b12-6+/t15?,18-/m0/s1
InChIKey IPKBXKLILHBHIZ-GJBGCBHJSA-N
Molecular Weight 274.404 g/mol
SMILES [C@](CC(OC(=O)C)C)(\C=C\C)(c1ccccc1)C(C)C
SPLASH splash10-00di-0900000000-a511c60c6ca538728291
Source of Spectrum CV-2005-1153-10
Wiley ID 1611667