SpectraBase Spectrum ID |
IRpYwjeckBQ |
Name |
Carbonic acid, monoamide, N-butyl-, 2-(benzyloxy)ethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
251.152143537 u |
Formula |
C14H21NO3 |
InChI |
InChI=1S/C14H21NO3/c1-2-3-9-15-14(16)18-11-10-17-12-13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3,(H,15,16) |
InChIKey |
PCMSTCYJODNKEO-UHFFFAOYSA-N |
Molecular Weight |
251.326 g/mol |
SMILES |
C(NCCCC)(=O)OCCOCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887137 |