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cis-Cyclohex-4-en-1,2-dicarboxylic acid, methyl butyl ester
SpectraBase Compound ID 2vqhKPAfoYy
InChI InChI=1S/C13H20O4/c1-3-4-9-17-13(15)11-8-6-5-7-10(11)12(14)16-2/h5-6,10-11H,3-4,7-9H2,1-2H3
InChIKey NSOZEIXUTXLBIR-UHFFFAOYSA-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 3iIMMlke3CD
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, methyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O4
InChI InChI=1S/C13H20O4/c1-3-4-9-17-13(15)11-8-6-5-7-10(11)12(14)16-2/h5-6,10-11H,3-4,7-9H2,1-2H3
InChIKey NSOZEIXUTXLBIR-UHFFFAOYSA-N
Molecular Weight 240.299 g/mol
SMILES C1C(C(CC=C1)C(OCCCC)=O)C(OC)=O
SPLASH splash10-004i-9500000000-f23183a812be13b916ca
Source of Spectrum TIPS-2023-827-0
Wiley ID 1885533