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

*Links on SpectraBase are not permalinks.
(E)-3-(6-formyl-1-cyclohepta-1,3,5-trienyl)-2-propenoic acid ethyl ester
SpectraBase Compound ID ESsq7ii6ZbP
InChI InChI=1S/C13H14O3/c1-2-16-13(15)8-7-11-5-3-4-6-12(9-11)10-14/h3-8,10H,2,9H2,1H3/b8-7+
InChIKey NHCBFJCALMSICD-BQYQJAHWSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 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 XTw8pbGRk
Name (E)-3-(6-formyl-1-cyclohepta-1,3,5-trienyl)-2-propenoic acid ethyl ester
Alternate Name(s) (E)-3-(6-formylcyclohepta-1,3,5-trien-1-yl)acrylic acid ethyl ester Ethyl (E)-3-(6-formylcyclohepta-1,3,5-trien-1-yl)prop-2-enoate Ethyl (E)-3-(6-methanoylcyclohepta-1,3,5-trien-1-yl)prop-2-enoate
CAS Registry Number 142797-62-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-2-16-13(15)8-7-11-5-3-4-6-12(9-11)10-14/h3-8,10H,2,9H2,1H3/b8-7+
InChIKey NHCBFJCALMSICD-BQYQJAHWSA-N
Molecular Weight 218.252 g/mol
SMILES C1(\C=C\C(=O)OCC)=CC=CC=C(C1)C=O
SPLASH splash10-014i-0930000000-f2b85ae9150abbbc6574
Source of Spectrum K-125-2228-2
Wiley ID 1217759