| SpectraBase Spectrum ID |
DbmOUYwuPYG |
| Name |
Cyclopentanecarboxaldehyde, 2-methyl-5-(1-methylethyl)-1-(3-oxobutyl)-, (1.alpha.,2.alpha.,5.alpha.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.177630011 u |
| Formula |
C14H24O2 |
| InChI |
InChI=1S/C14H24O2/c1-10(2)13-6-5-11(3)14(13,9-15)8-7-12(4)16/h9-11,13H,5-8H2,1-4H3/t11-,13-,14+/m0/s1 |
| InChIKey |
CCUPBDYAWFWFRX-FPMFFAJLSA-N |
| Molecular Weight |
224.344 g/mol |
| SMILES |
[C@@]1([C@@](CC[C@@]1(C)[H])(C(C)C)[H])(CCC(=O)C)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944434 |
