For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Cyclohexanecarboxylic acid, 1-(4-iodobutyl)-2-oxo-, ethyl ester
SpectraBase Compound ID HnC846tsEd0
InChI InChI=1S/C13H21IO3/c1-2-17-12(16)13(9-5-6-10-14)8-4-3-7-11(13)15/h2-10H2,1H3
InChIKey QAPXPXZYHFIMGL-UHFFFAOYSA-N
Mol Weight 352.21 g/mol
Molecular Formula C13H21IO3
Exact Mass 352.05354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B52xv0eYdJd
Name Cyclohexanecarboxylic acid, 1-(4-iodobutyl)-2-oxo-, ethyl ester
CAS Registry Number 110528-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21IO3
InChI InChI=1S/C13H21IO3/c1-2-17-12(16)13(9-5-6-10-14)8-4-3-7-11(13)15/h2-10H2,1H3
InChIKey QAPXPXZYHFIMGL-UHFFFAOYSA-N
Molecular Weight 352.212 g/mol
SMILES C1(C(=O)OCC)(C(=O)CCCC1)CCCCI
SPLASH splash10-00di-0910000000-c4b11d08a45ffdd92a36
Source of Spectrum F-45-89-34
Synonyms Ethyl 1-(4-iodobutyl)-2-oxocyclohexanecarboxylate Ethyl 1-(4-iodobutyl)-2-oxocyclohexanoate
Wiley ID 1342893