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3,4,5,6-Tetrahydro-3-methyl-1H-benzo[3,4]cyclohepta[1,2-c]furan-1-one
SpectraBase Compound ID 3vRqnvYJ9Sr
InChI InChI=1S/C14H14O2/c1-9-11-8-4-6-10-5-2-3-7-12(10)13(11)14(15)16-9/h2-3,5,7,9H,4,6,8H2,1H3
InChIKey PYDJOQSWHHCGGB-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C14H14O2
Exact Mass 214.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3GiUWNCTWy
Name 3,4,5,6-Tetrahydro-3-methyl-1H-benzo[3,4]cyclohepta[1,2-c]furan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O2
InChI InChI=1S/C14H14O2/c1-9-11-8-4-6-10-5-2-3-7-12(10)13(11)14(15)16-9/h2-3,5,7,9H,4,6,8H2,1H3
InChIKey PYDJOQSWHHCGGB-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1521-3897(200010)342_8_791
Molecular Weight 214.264 g/mol
SMILES C1(OC(C2=C1CCCc1c2cccc1)=O)C
SPLASH splash10-01vo-1920000000-fefbb9138a453fc0e9e7
Source of Spectrum JF-342-801-6f
Synonyms 3-Methyl-3,4,5,6-tetrahydro-1H-benzo[3,4]cyclohepta[1,2-c]furan-1-one
Wiley ID 1767089