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1-Cyclododecene-1-carboxylic acid, 12-oxo-, methyl ester, (E)-
SpectraBase Compound ID AtpfU4gwikr
InChI InChI=1S/C14H22O3/c1-17-14(16)12-10-8-6-4-2-3-5-7-9-11-13(12)15/h10H,2-9,11H2,1H3/b12-10+
InChIKey PKPKYMYGCLDQFD-ZRDIBKRKSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBORBkHsQdG
Name 1-Cyclododecene-1-carboxylic acid, 12-oxo-, methyl ester, (E)-
Alternate Name(s) Methyl 12-oxo-1-cyclododecene-1-carboxylate Methyl ester of (E)-12-oxo-1-cyclododecancarboxylic acid
CAS Registry Number 73392-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-17-14(16)12-10-8-6-4-2-3-5-7-9-11-13(12)15/h10H,2-9,11H2,1H3/b12-10+
InChIKey PKPKYMYGCLDQFD-ZRDIBKRKSA-N
Molecular Weight 238.327 g/mol
SMILES C(\C=1C(=O)CCCCCCCCCC\1)(=O)OC
SPLASH splash10-0a4i-9130000000-4cffd90274e27eefc143
Source of Spectrum H-62-2647-0
Wiley ID 1240744