SpectraBase Spectrum ID |
95WqOx51ynt |
Name |
syn/Anti-2-(1,2-epoxycyclohexyl)-3-buten-2-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
168.115029753 u |
Formula |
C10H16O2 |
InChI |
InChI=1S/C10H16O2/c1-3-9(2,11)10-7-5-4-6-8(10)12-10/h3,8,11H,1,4-7H2,2H3/t8-,9-,10+/m0/s1 |
InChIKey |
CAZPPCILMUJYDD-LPEHRKFASA-N |
Molecular Weight |
168.236 g/mol |
SMILES |
[C@]12(O[C@]2(CCCC1)[H])[C@](C=C)(O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.865495 |