SpectraBase Spectrum ID |
AQc7DOSk5kF |
Name |
Sarcosine, N-isobutyryl-, tetradecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
355.308644181 u |
Formula |
C21H41NO3 |
InChI |
InChI=1S/C21H41NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-25-20(23)18-22(4)21(24)19(2)3/h19H,5-18H2,1-4H3 |
InChIKey |
XSPARGVZEQSIPS-UHFFFAOYSA-N |
Molecular Weight |
355.563 g/mol |
SMILES |
CC(C)C(N(CC(OCCCCCCCCCCCCCC)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863149 |