| SpectraBase Spectrum ID |
FDSN7shcvqJ |
| Name |
Adamantane-1-carboxamide, N-benzyl-N-isobutyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.240564621 u |
| Formula |
C22H31NO |
| InChI |
InChI=1S/C22H31NO/c1-16(2)14-23(15-17-6-4-3-5-7-17)21(24)22-11-18-8-19(12-22)10-20(9-18)13-22/h3-7,16,18-20H,8-15H2,1-2H3/t18-,19+,20-,22- |
| InChIKey |
IQRKRLFGRXKUDT-GYDHJQQASA-N |
| Molecular Weight |
325.496 g/mol |
| SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CC=1C=CC=CC1)CC(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960913 |
