SpectraBase Spectrum ID |
8PCGzAA193C |
Name |
Amphetamine, N-butoxycarbonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.157228918 u |
Formula |
C14H21NO2 |
InChI |
InChI=1S/C14H21NO2/c1-3-4-10-17-14(16)15-12(2)11-13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,15,16) |
InChIKey |
FCFDPBOXJPNCIY-UHFFFAOYSA-N |
Molecular Weight |
235.327 g/mol |
SMILES |
C1=CC=CC(=C1)CC(NC(OCCCC)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872961 |