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4H-Inden-4-one, 1,2,3,5,6,7-hexahydro-
SpectraBase Compound ID LxWOFodDYdA
InChI InChI=1S/C9H12O/c10-9-6-2-4-7-3-1-5-8(7)9/h1-6H2
InChIKey UXSWKQVGKDBMOX-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 9J1OAgJCuWP
Name 4H-Inden-4-one, 1,2,3,5,6,7-hexahydro-
CAS Registry Number 22118-01-0
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c10-9-6-2-4-7-3-1-5-8(7)9/h1-6H2
InChIKey UXSWKQVGKDBMOX-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C12=C(CCC2)CCCC1=O
SPLASH splash10-000i-0900000000-eeb14d6a96726ed2381a
Source of Spectrum HE-1999-1036-0
Synonyms Bicyclo[4.3.0]non-1-en-2-one 1,2,3,5,6,7-Hexahydro-4H-inden-4-one 1,2,3,5,6,7-hexahydroinden-4-one
Wiley ID 1613516