SpectraBase Spectrum ID |
Cm35ApzfgvL |
Name |
Cyclohexnol, 2-isopropyl-5-methyl-o-[5-[1-cycloazapropyl]-N-pentyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
267.256214686 u |
Formula |
C17H33NO |
InChI |
InChI=1S/C17H33NO/c1-14(2)16-8-7-15(3)13-17(16)19-12-6-4-5-9-18-10-11-18/h14-17H,4-13H2,1-3H3 |
InChIKey |
AJDJCCAISAKQQA-UHFFFAOYSA-N |
Molecular Weight |
267.457 g/mol |
SMILES |
C1N(CCCCCOC2C(CCC(C2)C)C(C)C)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954786 |