| SpectraBase Spectrum ID |
Aw00eki1mK9 |
| Name |
(2S)-2-(Methoxymethyl)-N-[(1E,3R)-1-methyl-3-phenylbutylidene]pyrrolidin-1-amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.204513464 u |
| Formula |
C17H26N2O |
| InChI |
InChI=1S/C17H26N2O/c1-14(16-8-5-4-6-9-16)12-15(2)18-19-11-7-10-17(19)13-20-3/h4-6,8-9,14,17H,7,10-13H2,1-3H3/b18-15+/t14-,17+/m1/s1 |
| InChIKey |
MLILDFMVCAYGLR-UMTFQYRWSA-N |
| Molecular Weight |
274.408 g/mol |
| SMILES |
[C@]1(N(CCC1)\N=C\(C[C@@](C)(C=1C=CC=CC1)[H])C)(COC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919487 |
![(2S)-2-(Methoxymethyl)-N-[(1E,3R)-1-methyl-3-phenylbutylidene]pyrrolidin-1-amine](/api/spectrum/Aw00eki1mK9/structure.png?h=300&w=458 "(2S)-2-(Methoxymethyl)-N-[(1E,3R)-1-methyl-3-phenylbutylidene]pyrrolidin-1-amine")
