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3-Methyl-7-(1-hydroxyprop-2-yl)benzofuran-2-one
SpectraBase Compound ID 5ArcQ9d9IQL
InChI InChI=1S/C12H14O3/c1-7(6-13)9-4-3-5-10-8(2)12(14)15-11(9)10/h3-5,7-8,13H,6H2,1-2H3
InChIKey VQTFLCUQWFSWKR-UHFFFAOYSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGwkBM6ynRo
Name 3-Methyl-7-(1-hydroxyprop-2-yl)benzofuran-2-one
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 206.094294308 u
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-7(6-13)9-4-3-5-10-8(2)12(14)15-11(9)10/h3-5,7-8,13H,6H2,1-2H3
InChIKey VQTFLCUQWFSWKR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 206.241 g/mol
Nominal Mass 206 u
Quality 974
Retention Index 1529
SMILES OCC(C=1C2=C(C(C(O2)=O)C)C=CC1)C
SPLASH splash10-01ox-6900000000-324ff339fa4e544e0e09
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 7-(1-hydroxypropan-2-yl)-3-methyl-1-benzofuran-2(3H)-one
Technique GC/MS
Wiley ID DD2024_002287