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Bicyclo[4.1.0]hept-2-ene-7-acetic acid, 7-methyl-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-(.+-.)-
SpectraBase Compound ID 4I9si85YPRh
InChI InChI=1S/C11H16O2/c1-11(7-10(12)13-2)8-5-3-4-6-9(8)11/h3,5,8-9H,4,6-7H2,1-2H3/t8-,9+,11-/m0/s1
InChIKey TWBDWZIXRGOTMW-NGZCFLSTSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeEAguYvC4f
Name Bicyclo[4.1.0]hept-2-ene-7-acetic acid, 7-methyl-, methyl ester, (1.alpha.,6.alpha.,7.beta.)-(.+-.)-
CAS Registry Number 89044-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-11(7-10(12)13-2)8-5-3-4-6-9(8)11/h3,5,8-9H,4,6-7H2,1-2H3/t8-,9+,11-/m0/s1
InChIKey TWBDWZIXRGOTMW-NGZCFLSTSA-N
Molecular Weight 180.247 g/mol
SMILES [C@]1([C@]2(C=CCC[C@@]12[H])[H])(CC(=O)OC)C
SPLASH splash10-0a4l-7900000000-a3148e415f42da5d02b4
Source of Spectrum AJ-58-865-16
Synonyms Methyl exo-7-methylbicyclo[4.1.0]hept-2-ene-endo-7-acetate Methyl[(1S,6R,7R)-7-methylbicyclo[4.1.0]hept-2-en-7-yl]acetate
Wiley ID 1176611