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1-Methyl-3-phenylcyclopent-3-enecarbaldehyde

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

1-Methyl-3-phenylcyclopent-3-enecarbaldehyde
SpectraBase Compound ID 1qpYypCbUog
InChI InChI=1S/C13H14O/c1-13(10-14)8-7-12(9-13)11-5-3-2-4-6-11/h2-7,10H,8-9H2,1H3
InChIKey XGLPJTFXMPQNLW-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FasY6saPiTS
Name 1-Methyl-3-phenylcyclopent-3-enecarbaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 186.104465070 u
Formula C13H14O
InChI InChI=1S/C13H14O/c1-13(10-14)8-7-12(9-13)11-5-3-2-4-6-11/h2-7,10H,8-9H2,1H3
InChIKey XGLPJTFXMPQNLW-UHFFFAOYSA-N
Molecular Weight 186.254 g/mol
SMILES C1(=CCC(C1)(C=O)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929772