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2H-1-Benzopyran-3-carboxylic acid
SpectraBase Compound ID 3w8frATBeZO
InChI InChI=1S/C10H8O3/c11-10(12)8-5-7-3-1-2-4-9(7)13-6-8/h1-5H,6H2,(H,11,12)
InChIKey DEBZQUFVQZPPLC-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Ac7nWR6q3Q
Name 2H-1-Benzopyran-3-carboxylic acid
Alternate Name(s) 2H-chromene-3-carboxylic acid
CAS Registry Number 22649-28-1
Comments Less than 3 mono-isotopic peaks
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Formula C10H8O3
InChI InChI=1S/C10H8O3/c11-10(12)8-5-7-3-1-2-4-9(7)13-6-8/h1-5H,6H2,(H,11,12)
InChIKey DEBZQUFVQZPPLC-UHFFFAOYSA-N
Molecular Weight 176.171 g/mol
SMILES OC(=O)C1=Cc2c(cccc2)OC1
SPLASH splash10-0059-0900000000-a24d9943028b9f6651df
Source of Spectrum B-29-2744-0
Wiley ID 1172241