SpectraBase Spectrum ID |
1tjuj4KCvR3 |
Name |
Carbonic acid, monoamide, N-benzyl-N-decyl-, 2-methoxyethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.261693988 u |
Formula |
C21H35NO3 |
InChI |
InChI=1S/C21H35NO3/c1-3-4-5-6-7-8-9-13-16-22(21(23)25-18-17-24-2)19-20-14-11-10-12-15-20/h10-12,14-15H,3-9,13,16-19H2,1-2H3 |
InChIKey |
DMRVCHOSSVRHAC-UHFFFAOYSA-N |
Molecular Weight |
349.515 g/mol |
SMILES |
C(OCCOC)(=O)N(CCCCCCCCCC)CC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87808 |