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Benzene, 1,3,5-trimethyl-2-octadecyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

Benzene, 1,3,5-trimethyl-2-octadecyl-
SpectraBase Compound ID FRUUSHzdY5F
InChI InChI=1S/C27H48/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-25(3)22-24(2)23-26(27)4/h22-23H,5-21H2,1-4H3
InChIKey SDJSEINVDXJJCL-UHFFFAOYSA-N
Mol Weight 372.7 g/mol
Molecular Formula C27H48
Exact Mass 372.375602 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A3vKn9aCIij
Name Benzene, 1,3,5-trimethyl-2-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.375601546 u
Formula C27H48
InChI InChI=1S/C27H48/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27-25(3)22-24(2)23-26(27)4/h22-23H,5-21H2,1-4H3
InChIKey SDJSEINVDXJJCL-UHFFFAOYSA-N
Molecular Weight 372.681 g/mol
SMILES C(CC1=C(C)C=C(C=C1C)C)CCCCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.802584