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2,5-Hexadienoic acid, 3-ethoxy-

View entire compound with spectra: 1 MS (GC)

2,5-Hexadienoic acid, 3-ethoxy-
SpectraBase Compound ID 62MHSAqnMyA
InChI InChI=1S/C8H12O3/c1-3-5-7(11-4-2)6-8(9)10/h3,6H,1,4-5H2,2H3,(H,9,10)/b7-6+
InChIKey PDIIRQXSUUVOGR-VOTSOKGWSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkfgDTe5i5q
Name 2,5-Hexadienoic acid, 3-ethoxy-
CAS Registry Number 76966-06-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-3-5-7(11-4-2)6-8(9)10/h3,6H,1,4-5H2,2H3,(H,9,10)/b7-6+
InChIKey PDIIRQXSUUVOGR-VOTSOKGWSA-N
Molecular Weight 156.181 g/mol
SMILES OC(\C=C/(OCC)CC=C)=O
SPLASH splash10-067r-9300000000-3c25785b3617f48dede7
Source of Spectrum F-36-2296-0
Synonyms (2E)-3-ethoxy-2,5-hexadienoic acid 3-Ethoxy-2,5-hexadienoic acid
Wiley ID 1153363