| SpectraBase Spectrum ID |
H5vMoXdmgcz |
| Name |
(1S)-1-[(2S)-2-(Bromomethyl)-2-oxiranyl]-2-phenyl-N,N-bis(phenylmethyl)ethanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
435.119777460 u |
| Formula |
C25H26BrNO |
| InChI |
InChI=1S/C25H26BrNO/c26-19-25(20-28-25)24(16-21-10-4-1-5-11-21)27(17-22-12-6-2-7-13-22)18-23-14-8-3-9-15-23/h1-15,24H,16-20H2/t24-,25+/m0/s1 |
| InChIKey |
MLAVIXQPYCMYCD-LOSJGSFVSA-N |
| Molecular Weight |
436.393 g/mol |
| SMILES |
[C@@]1(OC1)([C@@](N(CC=1C=CC=CC1)CC1=CC=CC=C1)(CC1=CC=CC=C1)[H])CBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95892 |
![(1S)-1-[(2S)-2-(bromomethyl)-2-oxiranyl]-2-phenyl-N,N-bis(phenylmethyl)ethanamine](/api/spectrum/H5vMoXdmgcz/structure.png?h=300&w=458 "(1S)-1-[(2S)-2-(bromomethyl)-2-oxiranyl]-2-phenyl-N,N-bis(phenylmethyl)ethanamine")
