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(S)-(+)-2-methyl-3-phenyl-1-hexene

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

(S)-(+)-2-methyl-3-phenyl-1-hexene
SpectraBase Compound ID BWIMALgO07m
InChI InChI=1S/C13H18/c1-4-8-13(11(2)3)12-9-6-5-7-10-12/h5-7,9-10,13H,2,4,8H2,1,3H3/t13-/m0/s1
InChIKey UJWUFADZVZIGAS-ZDUSSCGKSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6wMAv0mmzPA
Name (S)-(+)-2-methyl-3-phenyl-1-hexene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 174.140850580 u
Formula C13H18
InChI InChI=1S/C13H18/c1-4-8-13(11(2)3)12-9-6-5-7-10-12/h5-7,9-10,13H,2,4,8H2,1,3H3/t13-/m0/s1
InChIKey UJWUFADZVZIGAS-ZDUSSCGKSA-N
Molecular Weight 174.287 g/mol
SMILES C1=CC=CC([C@](C(=C)C)(CCC)[H])=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.986228