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Sarcosine, N-(4-ethylbenzoyl)-, dodecyl ester

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

Sarcosine, N-(4-ethylbenzoyl)-, dodecyl ester
SpectraBase Compound ID GeNB9mnKZQu
InChI InChI=1S/C24H39NO3/c1-4-6-7-8-9-10-11-12-13-14-19-28-23(26)20-25(3)24(27)22-17-15-21(5-2)16-18-22/h15-18H,4-14,19-20H2,1-3H3
InChIKey PEBWNRYQPMZFDU-UHFFFAOYSA-N
Mol Weight 389.6 g/mol
Molecular Formula C24H39NO3
Exact Mass 389.292994 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ji64RMrLQeD
Name Sarcosine, N-(4-ethylbenzoyl)-, dodecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.292994117 u
Formula C24H39NO3
InChI InChI=1S/C24H39NO3/c1-4-6-7-8-9-10-11-12-13-14-19-28-23(26)20-25(3)24(27)22-17-15-21(5-2)16-18-22/h15-18H,4-14,19-20H2,1-3H3
InChIKey PEBWNRYQPMZFDU-UHFFFAOYSA-N
Molecular Weight 389.580 g/mol
SMILES C1=CC(=CC=C1C(N(CC(OCCCCCCCCCCCC)=O)C)=O)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.818461