| SpectraBase Spectrum ID |
EEb1hZfIj71 |
| Name |
(R)-2-Hexadecylcyclopropylidenebutanaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.323565971 u |
| Formula |
C23H42O |
| InChI |
InChI=1S/C23H42O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-21-23(22)19-16-17-20-24/h19-20,22H,2-18,21H2,1H3/b23-19+/t22-/m1/s1 |
| InChIKey |
IVZNCDQOIPBOAX-UPPUFSLMSA-N |
| Molecular Weight |
334.588 g/mol |
| SMILES |
C1\C([C@@]1(CCCCCCCCCCCCCCCC)[H])=C/CCC=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918335 |
