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

*Links on SpectraBase are not permalinks.
(2Z)-2-(3-hydroxy-3-methyl-2-benzofuranylidene)acetic acid ethyl ester
SpectraBase Compound ID 2DnCsa4vvx1
InChI InChI=1S/C13H14O4/c1-3-16-12(14)8-11-13(2,15)9-6-4-5-7-10(9)17-11/h4-8,15H,3H2,1-2H3/b11-8-
InChIKey SBRZYYWEKHKJJN-FLIBITNWSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 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 AwWmsxfZXg8
Name (2Z)-2-(3-hydroxy-3-methyl-2-benzofuranylidene)acetic acid ethyl ester
Alternate Name(s) (2Z)-2-(3-hydroxy-3-methyl-coumaran-2-ylidene)acetic acid ethyl ester ethyl (2Z)-2-(3-hydroxy-3-methyl-1-benzofuran-2-ylidene)acetate ethyl (2Z)-2-(3-hydroxy-3-methyl-benzofuran-2-ylidene)acetate ethyl (2Z)-2-(3-methyl-3-oxidanyl-1-benzofuran-2-ylidene)ethanoate
CAS Registry Number 123368-75-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-3-16-12(14)8-11-13(2,15)9-6-4-5-7-10(9)17-11/h4-8,15H,3H2,1-2H3/b11-8-
InChIKey SBRZYYWEKHKJJN-FLIBITNWSA-N
Molecular Weight 234.251 g/mol
SMILES OC1(\C(=C\C(=O)OCC)Oc2ccccc12)C
SPLASH splash10-03di-0910000000-63850d20dbdc654f0896
Source of Spectrum F-45-2039-32
Wiley ID 1235893