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2-Butanol, 4-[(phenylmethyl)thio]-, (R)-

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

2-Butanol, 4-[(phenylmethyl)thio]-, (R)-
SpectraBase Compound ID 9ETN0AJ97z6
InChI InChI=1S/C11H16OS/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-/m1/s1
InChIKey QNLMCPIIUNMSQO-SNVBAGLBSA-N
Mol Weight 196.31 g/mol
Molecular Formula C11H16OS
Exact Mass 196.092186 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HyBwTzP8uIE
Name 2-Butanol, 4-[(phenylmethyl)thio]-, (R)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.092186308 u
Formula C11H16OS
InChI InChI=1S/C11H16OS/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-/m1/s1
InChIKey QNLMCPIIUNMSQO-SNVBAGLBSA-N
Molecular Weight 196.308 g/mol
SMILES C(SCC=1C=CC=CC1)C[C@](O)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87936