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1-Hexadecanol

View entire compound with spectra: 13 NMR, 14 FTIR, 1 Raman, 50 MS (GC), and 2 Near IR

1-Hexadecanol
SpectraBase Compound ID 1tj46PkhzXK
InChI InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
InChIKey BXWNKGSJHAJOGX-UHFFFAOYSA-N
Mol Weight 242.4 g/mol
Molecular Formula C16H34O
Exact Mass 242.260966 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LeTVByhu6GG
Name 1-Hexadecanol
Acquisition Mode SIMULTANEOUS
CAS Registry Number 36653-82-4; 67762-30-5; 36311-34-9
ChEBI ID 16125
Comments Saturated 1-Hexadecanol - 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 C16 H34 O
IUPAC Name hexadecan-1-ol
InChI InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3
InChIKey BXWNKGSJHAJOGX-UHFFFAOYSA-N
KEGG Compound ID C00823
PubChem Compound ID 2682
SMILES CCCCCCCCCCCCCCCCO
Source File Reference bmse000487