SpectraBase Spectrum ID |
FWG8cJSrOrY |
Name |
Sarcosine, N-(3-phenylpropionyl)-, tetradecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
417.324294246 u |
Formula |
C26H43NO3 |
InChI |
InChI=1S/C26H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-17-22-30-26(29)23-27(2)25(28)21-20-24-18-15-14-16-19-24/h14-16,18-19H,3-13,17,20-23H2,1-2H3 |
InChIKey |
MSTSIIPKJANIEB-UHFFFAOYSA-N |
Molecular Weight |
417.634 g/mol |
SMILES |
C(CCC1=CC=CC=C1)(=O)N(CC(OCCCCCCCCCCCCCC)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921604 |