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Benzamide, 2-bromo-N-(2-pentyl)-N-dodecyl-

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

Benzamide, 2-bromo-N-(2-pentyl)-N-dodecyl-
SpectraBase Compound ID B1bk433rTYr
InChI InChI=1S/C24H40BrNO/c1-4-6-7-8-9-10-11-12-13-16-20-26(21(3)17-5-2)24(27)22-18-14-15-19-23(22)25/h14-15,18-19,21H,4-13,16-17,20H2,1-3H3
InChIKey MPHRLAORSNLTHD-UHFFFAOYSA-N
Mol Weight 438.5 g/mol
Molecular Formula C24H40BrNO
Exact Mass 437.229328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1eFe0vizLxG
Name Benzamide, 2-bromo-N-(2-pentyl)-N-dodecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.229327911 u
Formula C24H40BrNO
InChI InChI=1S/C24H40BrNO/c1-4-6-7-8-9-10-11-12-13-16-20-26(21(3)17-5-2)24(27)22-18-14-15-19-23(22)25/h14-15,18-19,21H,4-13,16-17,20H2,1-3H3
InChIKey MPHRLAORSNLTHD-UHFFFAOYSA-N
Molecular Weight 438.494 g/mol
SMILES C(N(C(CCC)C)C(=O)C=1C(Br)=CC=CC1)CCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.897793