| SpectraBase Spectrum ID |
5v7QL1Xqu0t |
| Name |
Trans-3-(hydroyxmethyl)-N,2,2-trimethyl-N-phenylcyclopropanecarboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
233.141578854 u |
| Formula |
C14H19NO2 |
| InChI |
InChI=1S/C14H19NO2/c1-14(2)11(9-16)12(14)13(17)15(3)10-7-5-4-6-8-10/h4-8,11-12,16H,9H2,1-3H3/t11-,12+/m1/s1 |
| InChIKey |
QJYGQJNYPLGBMO-NEPJUHHUSA-N |
| Molecular Weight |
233.311 g/mol |
| SMILES |
[C@]1(C(C)(C)[C@@]1(CO)[H])(C(N(C1=CC=CC=C1)C)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851456 |
