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(S)-7-Methyl-2-phenyloct-6-enenitrile

View entire compound with spectra: 1 NMR, and 1 FTIR

(S)-7-Methyl-2-phenyloct-6-enenitrile
SpectraBase Compound ID 9Mm9hAqvJ0P
InChI InChI=1S/C15H19N/c1-13(2)8-6-7-11-15(12-16)14-9-4-3-5-10-14/h3-5,8-10,15H,6-7,11H2,1-2H3/t15-/m1/s1
InChIKey RFHGKWPACWFAAM-OAHLLOKOSA-N
Mol Weight 213.32 g/mol
Molecular Formula C15H19N
Exact Mass 213.15175 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9WzlAMiTJ3J
Name (S)-7-Methyl-2-phenyloct-6-enenitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.151749616 u
Formula C15H19N
InChI InChI=1S/C15H19N/c1-13(2)8-6-7-11-15(12-16)14-9-4-3-5-10-14/h3-5,8-10,15H,6-7,11H2,1-2H3/t15-/m1/s1
InChIKey RFHGKWPACWFAAM-OAHLLOKOSA-N
Molecular Weight 213.324 g/mol
SMILES C([C@@](CCCC=C(C)C)(C1=CC=CC=C1)[H])#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847709