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2H-1-Benzopyran-5-acetic acid, 3,4-dihydro-2-methyl-4-oxo-
SpectraBase Compound ID I8cJ4SFdKT2
InChI InChI=1S/C12H12O4/c1-7-5-9(13)12-8(6-11(14)15)3-2-4-10(12)16-7/h2-4,7H,5-6H2,1H3,(H,14,15)
InChIKey DHRTVHQFRQLFTG-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmXo79CU2gD
Name 2H-1-Benzopyran-5-acetic acid, 3,4-dihydro-2-methyl-4-oxo-
CAS Registry Number 120714-33-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-7-5-9(13)12-8(6-11(14)15)3-2-4-10(12)16-7/h2-4,7H,5-6H2,1H3,(H,14,15)
InChIKey DHRTVHQFRQLFTG-UHFFFAOYSA-N
Molecular Weight 220.224 g/mol
SMILES OC(Cc1cccc2c1C(CC(C)O2)=O)=O
SPLASH splash10-0un9-1910000000-d65b7047dbf9364533a1
Source of Spectrum B-41-547-3
Synonyms (2-Methyl-4-oxo-3,4-dihydro-2H-chromen-5-yl)acetic acid 2-(2-Methyl-4-oxidanylidene-2,3-dihydrochromen-5-yl)ethanoic acid 2-(2-Methyl-4-oxo-2,3-dihydrochromen-5-yl)acetic acid 2-(2-Methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-5-yl)acetic acid 2-(2-Methyl-4-oxo-chroman-5-yl)acetic acid 2-(4-keto-2-methyl-chroman-5-yl)acetic acid
Wiley ID 1219663