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VZQKIRKYBKMSAZ-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

VZQKIRKYBKMSAZ-UHFFFAOYSA-N
SpectraBase Compound ID KVaQOcukwWC
InChI InChI=1S/C9H8O3/c1-5-3-2-4-6-7(5)9(11)12-8(6)10/h2-4,9,11H,1H3
InChIKey VZQKIRKYBKMSAZ-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C9H8O3
Exact Mass 164.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1t6PGwNmg76
Name 3-Hydroxy-4-methyl-3H-2-benzofuran-1-one
Alternate Name(s) 3-Hydroxy-4-methyl-3H-isobenzofuran-1-one 4-Methyl-3-oxidanyl-3H-2-benzofuran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O3
InChI InChI=1S/C9H8O3/c1-5-3-2-4-6-7(5)9(11)12-8(6)10/h2-4,9,11H,1H3
InChIKey VZQKIRKYBKMSAZ-UHFFFAOYSA-N
Molecular Weight 164.160 g/mol
SMILES OC1OC(c2cccc(c12)C)=O
SPLASH splash10-014i-2900000000-36a539a84d04c96a81b8
Source of Spectrum AH-127-211-11
Wiley ID 1160110