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3-acetyl isocoumarin
SpectraBase Compound ID Saq9wStwkq
InChI InChI=1S/C11H8O3/c1-7(12)10-6-8-4-2-3-5-9(8)11(13)14-10/h2-6H,1H3
InChIKey YZLUKAVLIALMCD-UHFFFAOYSA-N
Mol Weight 188.18 g/mol
Molecular Formula C11H8O3
Exact Mass 188.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Zd3NunEtr4
Name 3-acetyl isocoumarin
Appearance Light orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8O3
InChI InChI=1S/C11H8O3/c1-7(12)10-6-8-4-2-3-5-9(8)11(13)14-10/h2-6H,1H3
InChIKey YZLUKAVLIALMCD-UHFFFAOYSA-N
Instrument Name Agilent 19091 N-136
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2015.11.013
Molecular Weight 188.182 g/mol
SMILES c1ccc2c(c1)C(OC(=C2)C(=O)C)=O
SPLASH splash10-000j-5900000000-172d1685d408d760dec5
Source of Spectrum AJC-11-SM7-3
Wiley ID 1857244