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1,4-bis-(3-Cyanopropyl)-2,3,5,6-tetramethylbenzene

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

1,4-bis-(3-Cyanopropyl)-2,3,5,6-tetramethylbenzene
SpectraBase Compound ID LctBmDdtTLi
InChI InChI=1S/C18H24N2/c1-13-14(2)18(10-6-8-12-20)16(4)15(3)17(13)9-5-7-11-19/h5-10H2,1-4H3
InChIKey GQVFTNILSMTZBY-UHFFFAOYSA-N
Mol Weight 268.4 g/mol
Molecular Formula C18H24N2
Exact Mass 268.193949 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BQhKFBKC0je
Name 1,4-bis-(3-Cyanopropyl)-2,3,5,6-tetramethylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.193948781 u
Formula C18H24N2
InChI InChI=1S/C18H24N2/c1-13-14(2)18(10-6-8-12-20)16(4)15(3)17(13)9-5-7-11-19/h5-10H2,1-4H3
InChIKey GQVFTNILSMTZBY-UHFFFAOYSA-N
Molecular Weight 268.404 g/mol
SMILES C(#N)CCCC1=C(C(=C(C(=C1C)C)CCCC#N)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917604