| SpectraBase Spectrum ID |
4F9w3nRhFQy |
| Name |
Adamantane-1-carboxamide, N-(2-pentyl)-N-nonyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.350115072 u |
| Formula |
C25H45NO |
| InChI |
InChI=1S/C25H45NO/c1-4-6-7-8-9-10-11-13-26(20(3)12-5-2)24(27)25-17-21-14-22(18-25)16-23(15-21)19-25/h20-23H,4-19H2,1-3H3/t20?,21-,22+,23-,25- |
| InChIKey |
ZPCUJGALHVRQSS-VXYBSQBDSA-N |
| Molecular Weight |
375.641 g/mol |
| SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(C(C)CCC)CCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92423 |
