| SpectraBase Spectrum ID |
HBteBRZ6Q1 |
| Name |
3-Tert-butyl-trans-1,2-epoxycyclohexane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
154.135765199 u |
| Formula |
C10H18O |
| InChI |
InChI=1S/C10H18O/c1-10(2,3)7-5-4-6-8-9(7)11-8/h7-9H,4-6H2,1-3H3/t7?,8-,9-/m1/s1 |
| InChIKey |
SFXWZOTYAVHTJO-CFCGPWAMSA-N |
| Molecular Weight |
154.253 g/mol |
| SMILES |
[C@@]12(O[C@@]1(CCCC2C(C)(C)C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970665 |
