SpectraBase Spectrum ID |
HDPS5sqi9cp |
Name |
Bicyclo[9.3.1]pentadec-11-en-15-one, 12-amino- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.193614428 u |
Formula |
C15H25NO |
InChI |
InChI=1S/C15H25NO/c16-14-11-10-12-8-6-4-2-1-3-5-7-9-13(14)15(12)17/h12H,1-11,16H2 |
InChIKey |
HLTZIXKNUYYWDN-UHFFFAOYSA-N |
Molecular Weight |
235.371 g/mol |
SMILES |
C=12C(C(CCCCCCCCC2)CCC1N)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95426 |