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Bicyclo[4.3.0]non-3-en-7-one isomer
SpectraBase Compound ID 6mMG9DyIUhD
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-2,7-8H,3-6H2
InChIKey LOJATDUUSCWAOA-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ImYe9VIdk
Name Bicyclo[4.3.0]non-3-en-7-one isomer
CAS Registry Number 25050-74-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-2,7-8H,3-6H2
InChIKey LOJATDUUSCWAOA-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C1(C2C(CC=CC2)CC1)=O
SPLASH splash10-002u-9600000000-56b50d6daeb17503d393
Source of Spectrum O1-30-731-12
Synonyms 1-Indanone, 3a,4,7,7a-tetrahydro-, trans- 1H-Inden-1-one, 2,3,3a,4,7,7a-hexahydro-, cis- 1H-Inden-1-one, 2,3,3a,4,7,7a-hexahydro-, trans- 2,3,3a,4,7,7a-hexahydroinden-1-one
Wiley ID 818705