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7-Hydroxy-6-methoxy-3H-2-benzofuran-1-one
SpectraBase Compound ID As2r2Rr27Lh
InChI InChI=1S/C9H8O4/c1-12-6-3-2-5-4-13-9(11)7(5)8(6)10/h2-3,10H,4H2,1H3
InChIKey YJYWSBFTOXPGTL-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIEKOk91Ria
Name 7-Hydroxy-6-methoxy-3H-2-benzofuran-1-one
CAS Registry Number 29809-16-3
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 180.042258734 u
Formula C9H8O4
InChI InChI=1S/C9H8O4/c1-12-6-3-2-5-4-13-9(11)7(5)8(6)10/h2-3,10H,4H2,1H3
InChIKey YJYWSBFTOXPGTL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 180.159 g/mol
Nominal Mass 180 u
Quality 985
Retention Index 1338
SMILES OC1=C2C(=CC=C1OC)COC2=O
SPLASH splash10-0f89-3900000000-cf9ed0cacebc14a66306
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1(3H)-Isobenzofuraone,7-hydroxy-6-methoxy
Technique GC/MS
Wiley ID DD2024_029589