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DAQWLQVCDKFAPZ-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 2 MS (GC)

DAQWLQVCDKFAPZ-UHFFFAOYSA-N
SpectraBase Compound ID Aj6pKQKxZ8t
InChI InChI=1S/C8H10O2/c1-7(9)10-8-5-3-2-4-6-8/h2-3,5H,4,6H2,1H3
InChIKey DAQWLQVCDKFAPZ-UHFFFAOYSA-N
Mol Weight 138.17 g/mol
Molecular Formula C8H10O2
Exact Mass 138.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33S6YbtTRne
Name acetic acid 1-cyclohexa-1,3-dienyl ester
CAS Registry Number 74502-18-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10O2
InChI InChI=1S/C8H10O2/c1-7(9)10-8-5-3-2-4-6-8/h2-3,5H,4,6H2,1H3
InChIKey DAQWLQVCDKFAPZ-UHFFFAOYSA-N
Molecular Weight 138.166 g/mol
SMILES C(OC1=CC=CCC1)(=O)C
SPLASH splash10-0002-9000000000-43c9a4f0439273a1ffde
Source of Spectrum K-121-2001-7
Synonyms acetic acid cyclohexa-1,3-dien-1-yl ester cyclohexa-1,3-dien-1-yl acetate cyclohexa-1,3-dien-1-yl ethanoate
Wiley ID 1137857