SpectraBase Spectrum ID |
DzsZzo5Zl85 |
Name |
Sarcosine, N-benzyloxycarbonyl-, isohexyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
307.178358285 u |
Formula |
C17H25NO4 |
InChI |
InChI=1S/C17H25NO4/c1-14(2)8-7-11-21-16(19)12-18(3)17(20)22-13-15-9-5-4-6-10-15/h4-6,9-10,14H,7-8,11-13H2,1-3H3 |
InChIKey |
MIWATDBGIBGBBY-UHFFFAOYSA-N |
Molecular Weight |
307.390 g/mol |
SMILES |
CC(C)CCCOC(CN(C(OCC1=CC=CC=C1)=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.804482 |