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3,5-Cycloheptadien-1-one
SpectraBase Compound ID IsesybmVbIR
InChI InChI=1S/C7H8O/c8-7-5-3-1-2-4-6-7/h1-4H,5-6H2
InChIKey UNELZWLTCBQRGC-UHFFFAOYSA-N
Mol Weight 108.14 g/mol
Molecular Formula C7H8O
Exact Mass 108.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GlIOAr56MC4
Name 3,5-Cycloheptadien-1-one
CAS Registry Number 1121-65-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O
InChI InChI=1S/C7H8O/c8-7-5-3-1-2-4-6-7/h1-4H,5-6H2
InChIKey UNELZWLTCBQRGC-UHFFFAOYSA-N
Molecular Weight 108.140 g/mol
SMILES C=1C=CCC(=O)CC1
SPLASH splash10-002f-9100000000-8e69041a7e1d3520d16f
Source of Spectrum EP-5623-0-0
Synonyms 1-cyclohepta-3,5-dienone 3,5-Cycloheptadienone cyclohepta-3,5-dien-1-one
Wiley ID 1121864