SpectraBase Spectrum ID |
JQ1ShNO6281 |
Name |
Adamantan-1-carboxamide, N-propyl-N-(3-methylbutyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.256214686 u |
Formula |
C19H33NO |
InChI |
InChI=1S/C19H33NO/c1-4-6-20(7-5-14(2)3)18(21)19-11-15-8-16(12-19)10-17(9-15)13-19/h14-17H,4-13H2,1-3H3/t15-,16+,17-,19- |
InChIKey |
LPGQIXQUZRYWHW-SXOLKLDHSA-N |
SMILES |
C(=O)(N(CCC)CCC(C)C)C12C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878653 |