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3,4-Dihydro-6-methyl-2H-1,5-benzodioxepin-3-ol
SpectraBase Compound ID HLUkDFnxB0T
InChI InChI=1S/C10H12O3/c1-7-3-2-4-9-10(7)13-6-8(11)5-12-9/h2-4,8,11H,5-6H2,1H3
InChIKey ZJWBGTAZRFRVCR-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNNs824ftCA
Name 3,4-Dihydro-6-methyl-2H-1,5-benzodioxepin-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-7-3-2-4-9-10(7)13-6-8(11)5-12-9/h2-4,8,11H,5-6H2,1H3
InChIKey ZJWBGTAZRFRVCR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200790085
Molecular Weight 180.203 g/mol
SMILES OC1COc2cccc(c2OC1)C
SPLASH splash10-001r-2900000000-e677acd7b54d44ae3b07
Source of Spectrum H-90-1020-27a
Synonyms 6-Methyl-3,4-dihydro-2H-benzo[b][1,4]dioxepin-3-ol
Wiley ID 1783872