SpectraBase Spectrum ID |
LIXpXxPBUmZ |
Name |
Benzyl(2-benzyloxymethyloxiranylmethyl)amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
283.157228918 u |
Formula |
C18H21NO2 |
InChI |
InChI=1S/C18H21NO2/c1-3-7-16(8-4-1)11-19-13-18(15-21-18)14-20-12-17-9-5-2-6-10-17/h1-10,19H,11-15H2 |
InChIKey |
BQBFTVGYRFLMKM-UHFFFAOYSA-N |
SMILES |
C1(OC1)(CNCC=1C=CC=CC1)COCC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858945 |