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3-Methyl-7a-oxidanyl-4,5,6,7-tetrahydro-1-benzofuran-2-one

View entire compound with spectra: 1 MS (GC)

3-Methyl-7a-oxidanyl-4,5,6,7-tetrahydro-1-benzofuran-2-one
SpectraBase Compound ID BtpkQ413gFv
InChI InChI=1S/C9H12O3/c1-6-7-4-2-3-5-9(7,11)12-8(6)10/h11H,2-5H2,1H3
InChIKey FDOKOSVBJIGECW-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3E3IhtIPfk
Name 3-Methyl-7a-oxidanyl-4,5,6,7-tetrahydro-1-benzofuran-2-one
CAS Registry Number 15210-14-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-6-7-4-2-3-5-9(7,11)12-8(6)10/h11H,2-5H2,1H3
InChIKey FDOKOSVBJIGECW-UHFFFAOYSA-N
Molecular Weight 168.192 g/mol
SMILES OC12C(=C(C)C(O2)=O)CCCC1
SPLASH splash10-00l6-9200000000-b79a6ff96fc208f122b5
Source of Spectrum H-64-2276-0
Synonyms 7a-hydroxy-3-methyl-4,5,6,7-tetrahydro-1-benzofuran-2-one 7a-hydroxy-3-methyl-4,5,6,7-tetrahydrobenzofuran-2-one
Wiley ID 1164325