| SpectraBase Spectrum ID |
48yeMzfsY6Z |
| Name |
1-Benzyl-2-hydroxymethyl-cis-3-(p-methoxyphenylcarbamoyl)aziridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.147392509 u |
| Formula |
C18H20N2O3 |
| InChI |
InChI=1S/C18H20N2O3/c1-23-15-9-7-14(8-10-15)19-18(22)17-16(12-21)20(17)11-13-5-3-2-4-6-13/h2-10,16-17,21H,11-12H2,1H3,(H,19,22) |
| InChIKey |
APGUYSCNHIOHQC-UHFFFAOYSA-N |
| SMILES |
C1(N(C1C(NC1=CC=C(C=C1)OC)=O)CC1=CC=CC=C1)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869826 |
