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1-Cyclopropyl-4-(1,1-dimethylethylthio)-1-phenyl-1-butanol

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

1-Cyclopropyl-4-(1,1-dimethylethylthio)-1-phenyl-1-butanol
SpectraBase Compound ID 6dh7DLm4zIr
InChI InChI=1S/C17H26OS/c1-16(2,3)19-13-7-12-17(18,15-10-11-15)14-8-5-4-6-9-14/h4-6,8-9,15,18H,7,10-13H2,1-3H3
InChIKey VHPZGJRCWVERFP-UHFFFAOYSA-N
Mol Weight 278.45 g/mol
Molecular Formula C17H26OS
Exact Mass 278.170437 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1JXcbZeepzt
Name 1-Cyclopropyl-4-(1,1-dimethylethylthio)-1-phenyl-1-butanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.170436630 u
Formula C17H26OS
InChI InChI=1S/C17H26OS/c1-16(2,3)19-13-7-12-17(18,15-10-11-15)14-8-5-4-6-9-14/h4-6,8-9,15,18H,7,10-13H2,1-3H3
InChIKey VHPZGJRCWVERFP-UHFFFAOYSA-N
Molecular Weight 278.454 g/mol
SMILES C(CCCSC(C)(C)C)(O)(C=1C=CC=CC1)C1CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909469