| SpectraBase Spectrum ID |
1uiCYISzghh |
| Name |
Adamantan-1-carboxamide, N-propyl-N-butyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.240564621 u |
| Formula |
C18H31NO |
| InChI |
InChI=1S/C18H31NO/c1-3-5-7-19(6-4-2)17(20)18-11-14-8-15(12-18)10-16(9-14)13-18/h14-16H,3-13H2,1-2H3/t14-,15+,16-,18- |
| InChIKey |
HYQKQBYEDLSHRU-CMIRHGDUSA-N |
| Molecular Weight |
277.452 g/mol |
| SMILES |
C(=O)(N(CCC)CCCC)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974681 |
