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6H-2-Benzopyran-6-one, 1,3,4,7,8,8a-hexahydro-
SpectraBase Compound ID JOTeD5byst8
InChI InChI=1S/C9H12O2/c10-9-2-1-8-6-11-4-3-7(8)5-9/h5,8H,1-4,6H2
InChIKey VVTXBQICDZEGQP-UHFFFAOYSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dfgj4Ti9632
Name 6H-2-Benzopyran-6-one, 1,3,4,7,8,8a-hexahydro-
CAS Registry Number 96728-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c10-9-2-1-8-6-11-4-3-7(8)5-9/h5,8H,1-4,6H2
InChIKey VVTXBQICDZEGQP-UHFFFAOYSA-N
Molecular Weight 152.193 g/mol
SMILES C12=CC(=O)CCC2COCC1
SPLASH splash10-052f-9800000000-d142a55ec6bda0e12e21
Source of Spectrum J-50-2610-4
Synonyms 1,3,4,7,8,8a-hexahydro-6H-2-benzopyran-6-one 4-Oxa-bicyclo[4.4.0]decan-10(1)-en-9-one
Wiley ID 1149104