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Benzamide, 4-ethyl-N-(2-pentyl)-N-(2-ethylhexyl)-
SpectraBase Compound ID 6fCBCsTL60J
InChI InChI=1S/C22H37NO/c1-6-10-12-20(9-4)17-23(18(5)11-7-2)22(24)21-15-13-19(8-3)14-16-21/h13-16,18,20H,6-12,17H2,1-5H3
InChIKey XARMNSFGHWUYEI-UHFFFAOYSA-N
Mol Weight 331.5 g/mol
Molecular Formula C22H37NO
Exact Mass 331.287515 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 76RohR6uSoU
Name Benzamide, 4-ethyl-N-(2-pentyl)-N-(2-ethylhexyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.287514814 u
Formula C22H37NO
InChI InChI=1S/C22H37NO/c1-6-10-12-20(9-4)17-23(18(5)11-7-2)22(24)21-15-13-19(8-3)14-16-21/h13-16,18,20H,6-12,17H2,1-5H3
InChIKey XARMNSFGHWUYEI-UHFFFAOYSA-N
Molecular Weight 331.544 g/mol
SMILES C(C1=CC=C(C=C1)CC)(=O)N(CC(CCCC)CC)C(CCC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953031