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(2S,3R)-3-Methylpentadecan-2-ol

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

(2S,3R)-3-Methylpentadecan-2-ol
SpectraBase Compound ID ExkexVmGdAL
InChI InChI=1S/C16H34O/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)16(3)17/h15-17H,4-14H2,1-3H3/t15-,16+/m1/s1
InChIKey DEKUYNCVBPPRHT-CVEARBPZSA-N
Mol Weight 242.4 g/mol
Molecular Formula C16H34O
Exact Mass 242.260966 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8n5SinHPZnS
Name (2S,3R)-3-Methylpentadecan-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.260965714 u
Formula C16H34O
InChI InChI=1S/C16H34O/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)16(3)17/h15-17H,4-14H2,1-3H3/t15-,16+/m1/s1
InChIKey DEKUYNCVBPPRHT-CVEARBPZSA-N
Molecular Weight 242.447 g/mol
SMILES [C@@]([C@@](CCCCCCCCCCCC)(C)[H])(O)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907413