| SpectraBase Spectrum ID |
7zGyHU9pwRo |
| Name |
2-Heptanone, 6-methyl-6-[3-methyl-3-(1-methylethenyl)-1-cyclopropen-1-yl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.182715392 u |
| Formula |
C15H24O |
| InChI |
InChI=1S/C15H24O/c1-11(2)15(6)10-13(15)14(4,5)9-7-8-12(3)16/h10H,1,7-9H2,2-6H3 |
| InChIKey |
GMBJCJXDGAGJEN-UHFFFAOYSA-N |
| Molecular Weight |
220.356 g/mol |
| SMILES |
C(CCCC(C)=O)(C)(C)C=1C(C(C)=C)(C)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938227 |
![2-Heptanone, 6-methyl-6-[3-methyl-3-(1-methylethenyl)-1-cyclopropen-1-yl]-](/api/spectrum/7zGyHU9pwRo/structure.png?h=300&w=458 "2-Heptanone, 6-methyl-6-[3-methyl-3-(1-methylethenyl)-1-cyclopropen-1-yl]-")
