| SpectraBase Spectrum ID |
JrE2njmaOMq |
| Name |
Adamantane-1-carboxamide, N-allyl-N-(3-methylbutyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.240564621 u |
| Formula |
C19H31NO |
| InChI |
InChI=1S/C19H31NO/c1-4-6-20(7-5-14(2)3)18(21)19-11-15-8-16(12-19)10-17(9-15)13-19/h4,14-17H,1,5-13H2,2-3H3/t15-,16+,17-,19- |
| InChIKey |
QRDNBHOVXPEKEV-SXOLKLDHSA-N |
| Molecular Weight |
289.463 g/mol |
| SMILES |
C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(CCC(C)C)CC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913139 |
