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

*Links on SpectraBase are not permalinks.
1,6-Cycloheptadiene-1-carboxylic acid, 3-(2-methoxy-1-methylene-2-oxoethoxy)-, methyl ester, (.+-.)-
SpectraBase Compound ID 4uKecjiFpyi
InChI InChI=1S/C13H16O5/c1-9(12(14)16-2)18-11-7-5-4-6-10(8-11)13(15)17-3/h4,6,8,11H,1,5,7H2,2-3H3
InChIKey WMUJAMGKJLVJOS-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 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 8OrkzEl58uw
Name 1,6-Cycloheptadiene-1-carboxylic acid, 3-(2-methoxy-1-methylene-2-oxoethoxy)-, methyl ester, (.+-.)-
CAS Registry Number 115651-66-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-9(12(14)16-2)18-11-7-5-4-6-10(8-11)13(15)17-3/h4,6,8,11H,1,5,7H2,2-3H3
InChIKey WMUJAMGKJLVJOS-UHFFFAOYSA-N
Molecular Weight 252.266 g/mol
SMILES C1(C(=O)OC)=CC(OC(C(=O)OC)=C)CCC=C1
SPLASH splash10-0006-9600000000-f29997d166201603a61b
Source of Spectrum J-53-4068-4
Synonyms Methyl 3-[[1-(methoxycarbonyl)ethenyl]oxy]cyclohepta-1,6-diene-1-carboxylate Methyl 3-{[1-(methoxycarbonyl)vinyl]oxy}-1,6-cycloheptadiene-1-carboxylate
Wiley ID 1255356