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5H-Benzo[3,4]cyclobuta[1,2]cyclohepten-5-one, 4b,6,7,8-tetrahydro-
SpectraBase Compound ID 1AWBQtqwMEP
InChI InChI=1S/C13H12O/c14-12-8-4-3-7-11-9-5-1-2-6-10(9)13(11)12/h1-3,5-7,11,13H,4,8H2
InChIKey QBTMXKHZKRROJZ-UHFFFAOYSA-N
Mol Weight 184.24 g/mol
Molecular Formula C13H12O
Exact Mass 184.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5r9CMV9288J
Name 5H-Benzo[3,4]cyclobuta[1,2]cyclohepten-5-one, 4b,6,7,8-tetrahydro-
CAS Registry Number 55386-30-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O
InChI InChI=1S/C13H12O/c14-12-8-4-3-7-11-9-5-1-2-6-10(9)13(11)12/h1-3,5-7,11,13H,4,8H2
InChIKey QBTMXKHZKRROJZ-UHFFFAOYSA-N
Molecular Weight 184.238 g/mol
SMILES C12C(C(=O)CCC=C2)c2c1cccc2
SPLASH splash10-0059-0900000000-4a6b4857ee00a6c4e171
Source of Spectrum B-31-1601-0
Synonyms 4b,6,7,9a-tetrahydro-5H-benzo[3,4]cyclobuta[1,2-a]cyclohepten-5-one 7,8-Dihydro-6H-benzo[3,4]cyclobuta[1,2]cyclohepten-5(4bH)-one
Wiley ID 1181402