SpectraBase Compound ID | 15rkwWBMnoK |
---|---|
InChI | InChI=1S/C18H19NO/c19-17(20)18(15-10-5-2-6-11-15)13-7-12-16(18)14-8-3-1-4-9-14/h1-6,8-11,16H,7,12-13H2,(H2,19,20)/t16-,18+/m1/s1 InChI=1S/C18H19NO/c19-17(20)18(15-10-5-2-6-11-15)13-7-12-16(18)14-8-3-1-4-9-14/h1-6,8-11,16H,7,12-13H2,(H2,19,20)/t16-,18+/m0/s1 |
InChIKey | YLYHOMOMJVGJGT-AEFFLSMTSA-N |
Mol Weight | 265.36 g/mol |
Molecular Formula | C18H19NO |
Exact Mass | 265.146664 g/mol |
SpectraBase Spectrum ID | 6AvFiXHW6Yf |
---|---|
Name | 1,2-Trans-diphenylcyclopentanecarboxamide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 265.146664235 u |
Formula | C18H19NO |
InChI | InChI=1S/C18H19NO/c19-17(20)18(15-10-5-2-6-11-15)13-7-12-16(18)14-8-3-1-4-9-14/h1-6,8-11,16H,7,12-13H2,(H2,19,20)/t16-,18+/m1/s1 |
InChIKey | YLYHOMOMJVGJGT-AEFFLSMTSA-N |
Molecular Weight | 265.356 g/mol |
SMILES | NC([C@@]1(CCC[C@@]1(C=1C=CC=CC1)[H])C=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Raman) | 0.986509 |