| SpectraBase Spectrum ID |
Dmrbud1UmE3 |
| Name |
Adamantane-1-carboxamide, N-benzyl-N-pentyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.256214686 u |
| Formula |
C23H33NO |
| InChI |
InChI=1S/C23H33NO/c1-2-3-7-10-24(17-18-8-5-4-6-9-18)22(25)23-14-19-11-20(15-23)13-21(12-19)16-23/h4-6,8-9,19-21H,2-3,7,10-17H2,1H3/t19-,20+,21-,23- |
| InChIKey |
CIHOUFVHFDKKNF-HOFYVFDJSA-N |
| Molecular Weight |
339.523 g/mol |
| SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CC=1C=CC=CC1)CCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.906464 |
