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2-Indanone
SpectraBase Compound ID 5juYzwW4S7t
InChI InChI=1S/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H2
InChIKey UMJJFEIKYGFCAT-UHFFFAOYSA-N
Mol Weight 132.16 g/mol
Molecular Formula C9H8O
Exact Mass 132.057515 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ngoqPQGGNF
Name 2-Indanone
Acquisition Mode SIMULTANEOUS
CAS Registry Number 615-13-4
ChEBI ID 27930
Comments Saturated 2-Indanone - Sigma-Aldrich Solvent CDCl3, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C9 H8 O
IUPAC Name 1,3-dihydroinden-2-one; indan-2-one; 2-indanone
InChI InChI=1S/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H2
InChIKey UMJJFEIKYGFCAT-UHFFFAOYSA-N
KEGG Compound ID C07727
KEGG Pathways PATH: ko00628 Fluorene degradation
PubChem Compound ID 11983
SMILES C1C(=O)CC2=CC=CC=C21
Source File Reference bmse000514