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(+/-)-(2'S*,6'S*,7'S*)-ETHYL-2'-METHYL-8'-OXOBICYCLO-[4.3.0]-NON-9'-EN-7'-YL-ACETATE
SpectraBase Compound ID LZHAWfxQ364
InChI InChI=1S/C14H20O3/c1-3-17-14(16)8-12-10-6-4-5-9(2)11(10)7-13(12)15/h7,9-10,12H,3-6,8H2,1-2H3/t9-,10+,12-/m0/s1
InChIKey FKQHRQSCQIZNEE-UMNHJUIQSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FphWxsHIcV
Name 1H-Indene-1-acetic acid, 2,4,5,6,7,7a-hexahydro-4-methyl-2-oxo-, ethyl ester, (1.alpha.,4.beta.,7a.alpha.)-(.+-.)-
Alternate Name(s) (+-)-(2'S,6S,7S)Ethyl-2'-methyl-8-oxobicyclo[4.3.0]non-9'en-7'-yl acetate Ethyl[(1S,4S,7aS)-4-methyl-2-oxo-2,4,5,6,7,7a-hexahydro-1H-inden-1-yl]acetate
CAS Registry Number 128890-81-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-3-17-14(16)8-12-10-6-4-5-9(2)11(10)7-13(12)15/h7,9-10,12H,3-6,8H2,1-2H3/t9-,10+,12-/m0/s1
InChIKey FKQHRQSCQIZNEE-UMNHJUIQSA-N
Molecular Weight 236.311 g/mol
SMILES C12=CC(=O)[C@]([C@@]2(CCC[C@@]1(C)[H])[H])(CC(=O)OCC)[H]
SPLASH splash10-03du-0920000000-48d31f538808a9ea388f
Source of Spectrum F-46-417-18
Wiley ID 1238393