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3-(Hydroxymethyl)-5-phenylpent-4-yn-2-en-1-ol

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

3-(Hydroxymethyl)-5-phenylpent-4-yn-2-en-1-ol
SpectraBase Compound ID FXyoEho7z7Q
InChI InChI=1S/C12H12O2/c13-9-8-12(10-14)7-6-11-4-2-1-3-5-11/h1-5,8,13-14H,9-10H2/b12-8-
InChIKey NLNYHKJFZQDPAN-WQLSENKSSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3Ed3LFBWHey
Name 3-(Hydroxymethyl)-5-phenylpent-4-yn-2-en-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 188.083729624 u
Formula C12H12O2
InChI InChI=1S/C12H12O2/c13-9-8-12(10-14)7-6-11-4-2-1-3-5-11/h1-5,8,13-14H,9-10H2/b12-8-
InChIKey NLNYHKJFZQDPAN-WQLSENKSSA-N
Molecular Weight 188.226 g/mol
SMILES C(\C=C\(C#CC=1C=CC=CC1)CO)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.83474