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2-Phenyl-spiro[4.5]dec-2-en-6-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Phenyl-spiro[4.5]dec-2-en-6-one
SpectraBase Compound ID GL8n1UCw2VE
InChI InChI=1S/C16H18O/c17-15-8-4-5-10-16(15)11-9-14(12-16)13-6-2-1-3-7-13/h1-3,6-7,9H,4-5,8,10-12H2
InChIKey BKMDLHCFANVGDB-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID It5KhaZAMeG
Name 2-Phenyl-spiro[4.5]dec-2-en-6-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.135765199 u
Formula C16H18O
InChI InChI=1S/C16H18O/c17-15-8-4-5-10-16(15)11-9-14(12-16)13-6-2-1-3-7-13/h1-3,6-7,9H,4-5,8,10-12H2
InChIKey BKMDLHCFANVGDB-UHFFFAOYSA-N
Molecular Weight 226.319 g/mol
SMILES C=1(CC2(C(=O)CCCC2)CC1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.903751