| SpectraBase Spectrum ID |
ECoFsMKehuC |
| Name |
(1S*,2R*)-N,N-Diethyl-1,2-dimethyl-2-phenylcyclopropanecarboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.177964364 u |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-5-17(6-2)14(18)16(4)12-15(16,3)13-10-8-7-9-11-13/h7-11H,5-6,12H2,1-4H3/t15-,16-/m1/s1 |
| InChIKey |
BDEMHLKGXCMDQI-HZPDHXFCSA-N |
| Molecular Weight |
245.366 g/mol |
| SMILES |
C(=O)(N(CC)CC)[C@@]1([C@@](C)(C2=CC=CC=C2)C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920279 |
