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Ethyl ester of trans-2-(Acetyloxy)-.alpha.-methylenecyclohexaneacetic acid
SpectraBase Compound ID 4moqru7iThS
InChI InChI=1S/C13H20O4/c1-4-16-13(15)9(2)11-7-5-6-8-12(11)17-10(3)14/h11-12H,2,4-8H2,1,3H3/t11-,12+/m0/s1
InChIKey FYLIPEIXUZOELC-NWDGAFQWSA-N
Mol Weight 240.3 g/mol
Molecular Formula C13H20O4
Exact Mass 240.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFwlbCOLJ5e
Name Ethyl ester of trans-2-(Acetyloxy)-.alpha.-methylenecyclohexaneacetic acid
Alternate Name(s) Ethyl 2-[(1S,2R)-2-(acetyloxy)cyclohexyl]acrylate
CAS Registry Number 68582-77-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-4-16-13(15)9(2)11-7-5-6-8-12(11)17-10(3)14/h11-12H,2,4-8H2,1,3H3/t11-,12+/m0/s1
InChIKey FYLIPEIXUZOELC-NWDGAFQWSA-N
Molecular Weight 240.299 g/mol
SMILES C([C@]1([C@](OC(=O)C)(CCCC1)[H])[H])(C(=O)OCC)=C
SPLASH splash10-0ue9-0900000000-641bc6c98f67f819b447
Source of Spectrum J-44-791-0
Wiley ID 1242834