| SpectraBase Spectrum ID |
7zIdWVg4aRn |
| Name |
1H-Cyclopentacyclododecen-1-one, tetradecahydro-2-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
236.214015521 u |
| Formula |
C16H28O |
| InChI |
InChI=1S/C16H28O/c1-13-12-14-10-8-6-4-2-3-5-7-9-11-15(14)16(13)17/h13-15H,2-12H2,1H3 |
| InChIKey |
YISWSDZNLVLTDK-UHFFFAOYSA-N |
| Molecular Weight |
236.399 g/mol |
| SMILES |
C1(C2C(CCCCCCCCCC2)CC1C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940252 |
