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Bicyclo[4.1.0]hept-2-ene-7-acetic acid, 3-methyl-7-(4-methyl-3-pentenyl)-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-(.+-.)-
SpectraBase Compound ID GAvv7DSKrJQ
InChI InChI=1S/C17H26O2/c1-12(2)6-5-9-17(11-16(18)19-4)14-8-7-13(3)10-15(14)17/h6,10,14-15H,5,7-9,11H2,1-4H3/t14-,15+,17-/m1/s1
InChIKey SEZSSUNCAKNBSN-HLLBOEOZSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4XckWvbAiYn
Name Bicyclo[4.1.0]hept-2-ene-7-acetic acid, 3-methyl-7-(4-methyl-3-pentenyl)-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-(.+-.)-
Alternate Name(s) 3-Methyl-7-(methoxycarbonylmethyl)-7-(4-methyl-3-pentenyl)bicyclo[5.1.0]hepta-2-ene Methyl[(1S,6R,7R)-3-methyl-7-(4-methyl-3-pentenyl)bicyclo[4.1.0]hept-2-en-7-yl]acetate
CAS Registry Number 86105-55-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12(2)6-5-9-17(11-16(18)19-4)14-8-7-13(3)10-15(14)17/h6,10,14-15H,5,7-9,11H2,1-4H3/t14-,15+,17-/m1/s1
InChIKey SEZSSUNCAKNBSN-HLLBOEOZSA-N
Molecular Weight 262.393 g/mol
SMILES [C@]1([C@]2(C=C(C)CC[C@@]12[H])[H])(CC(=O)OC)CCC=C(C)C
SPLASH splash10-02xs-0910000000-43bc25c7ddd030558a66
Source of Spectrum AJ-58-215-25
Wiley ID 1266331