| SpectraBase Spectrum ID |
35XirI9rKs6 |
| Name |
syn-2-Chloromethyl-5-methyl-6-ethyloxacyclohex-3-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
174.081142802 u |
| Formula |
C9H15ClO |
| InChI |
InChI=1S/C9H15ClO/c1-3-9-7(2)4-5-8(6-10)11-9/h4-5,7-9H,3,6H2,1-2H3/t7?,8-,9-/m0/s1 |
| InChIKey |
WJDUBJZUBBXVBH-NPPUSCPJSA-N |
| Molecular Weight |
174.671 g/mol |
| SMILES |
[C@@]1(O[C@@](C=CC1C)(CCl)[H])(CC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927521 |
