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

*Links on SpectraBase are not permalinks.
2-(4-Carboethoxy-3-butenyl)cyclohexen-1-one
SpectraBase Compound ID LHDe5SWohYj
InChI InChI=1S/C13H18O3/c1-2-16-13(15)10-6-4-8-11-7-3-5-9-12(11)14/h6-7,10H,2-5,8-9H2,1H3/b10-6+
InChIKey CZJVULQTCGOFIW-UXBLZVDNSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 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 4hWvTdLB1k
Name 2-(4-Carboethoxy-3-butenyl)cyclohexen-1-one
Alternate Name(s) 2-(4-Carboethoxy-3-butenyl)-2-cyclohexen-1-one Ethyl (2E)-5-(6-oxo-1-cyclohexen-1-yl)-2-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-2-16-13(15)10-6-4-8-11-7-3-5-9-12(11)14/h6-7,10H,2-5,8-9H2,1H3/b10-6+
InChIKey CZJVULQTCGOFIW-UXBLZVDNSA-N
Molecular Weight 222.284 g/mol
SMILES C=1(C(=O)CCCC1)CC\C=C\C(=O)OCC
SPLASH splash10-008c-5900000000-5d7bedb2ea8db4ebf81a
Source of Spectrum C-119-8785-21
Wiley ID 760629