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3-Tert-butyl-1-phenylbut-3-en-2-ol

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

3-Tert-butyl-1-phenylbut-3-en-2-ol
SpectraBase Compound ID HJSi4NXn6Yk
InChI InChI=1S/C14H20O/c1-11(14(2,3)4)13(15)10-12-8-6-5-7-9-12/h5-9,13,15H,1,10H2,2-4H3
InChIKey ZZNLPGUMXFXHMI-UHFFFAOYSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8vRNCXiFUuH
Name 3-Tert-butyl-1-phenylbut-3-en-2-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 204.151415263 u
Formula C14H20O
InChI InChI=1S/C14H20O/c1-11(14(2,3)4)13(15)10-12-8-6-5-7-9-12/h5-9,13,15H,1,10H2,2-4H3
InChIKey ZZNLPGUMXFXHMI-UHFFFAOYSA-N
Molecular Weight 204.313 g/mol
SMILES C(C(C(=C)C(C)(C)C)O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.939789