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2-Dodecyn-1-ol, 12-phenyl-

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

2-Dodecyn-1-ol, 12-phenyl-
SpectraBase Compound ID IYKnv8SAXGl
InChI InChI=1S/C18H26O/c19-17-13-8-6-4-2-1-3-5-7-10-14-18-15-11-9-12-16-18/h9,11-12,15-16,19H,1-7,10,14,17H2
InChIKey QQXRLNRQPZEHOU-UHFFFAOYSA-N
Mol Weight 258.4 g/mol
Molecular Formula C18H26O
Exact Mass 258.198365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 66gOTGT0Kd4
Name 2-Dodecyn-1-ol, 12-phenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.198365456 u
Formula C18H26O
InChI InChI=1S/C18H26O/c19-17-13-8-6-4-2-1-3-5-7-10-14-18-15-11-9-12-16-18/h9,11-12,15-16,19H,1-7,10,14,17H2
InChIKey QQXRLNRQPZEHOU-UHFFFAOYSA-N
Molecular Weight 258.405 g/mol
SMILES C(#CCCCCCCCCCC=1C=CC=CC1)CO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.896877