| SpectraBase Spectrum ID |
F5mQXmqr2kN |
| Name |
(2S,3S)-3-Chloromethyl-2-methyl-2-(4-methyl-pent-3-enyl)-oxirane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
188.096792866 u |
| Formula |
C10H17ClO |
| InChI |
InChI=1S/C10H17ClO/c1-8(2)5-4-6-10(3)9(7-11)12-10/h5,9H,4,6-7H2,1-3H3/t9-,10+/m1/s1 |
| InChIKey |
BNXBPMUPFGVHRD-ZJUUUORDSA-N |
| Molecular Weight |
188.698 g/mol |
| SMILES |
[C@@]1(O[C@@]1(CCl)[H])(CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971044 |
