SpectraBase Spectrum ID |
1gDZdoBywx0 |
Name |
Adamantane-1-carboxamide, N-(2-pentyl)-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
389.365765136 u |
Formula |
C26H47NO |
InChI |
InChI=1S/C26H47NO/c1-4-6-7-8-9-10-11-12-14-27(21(3)13-5-2)25(28)26-18-22-15-23(19-26)17-24(16-22)20-26/h21-24H,4-20H2,1-3H3/t21?,22-,23+,24-,26- |
InChIKey |
FZAVXLDIFPXDGF-QJVUDHKOSA-N |
Molecular Weight |
389.668 g/mol |
SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(C(C)CCC)CCCCCCCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94131 |