| SpectraBase Spectrum ID |
4zGbmatXj8T |
| Name |
Spiro[7-oxabicyclo[4.1.0]heptane-2,2'-oxirane], 1,5,5-trimethyl-6-(3-methyl-1,3-butadienyl)-, [1.alpha.,2.alpha.,6.alpha.(E)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.161979946 u |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-11(2)6-7-15-12(3,4)8-9-14(10-16-14)13(15,5)17-15/h6-7H,1,8-10H2,2-5H3/b7-6+/t13-,14-,15+/m0/s1 |
| InChIKey |
OPOTUHBLQKEXDH-MNZAGANASA-N |
| Molecular Weight |
234.339 g/mol |
| SMILES |
[C@@]12([C@@](\C=C\C(=C)C)(C(C)(C)CC[C@@]22OC2)O1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960333 |
![Spiro[7-oxabicyclo[4.1.0]heptane-2,2'-oxirane], 1,5,5-trimethyl-6-(3-methyl-1,3-butadienyl)-, [1.alpha.,2.alpha.,6.alpha.(E)]-](/api/spectrum/4zGbmatXj8T/structure.png?h=300&w=458 "Spiro[7-oxabicyclo[4.1.0]heptane-2,2'-oxirane], 1,5,5-trimethyl-6-(3-methyl-1,3-butadienyl)-, [1.alpha.,2.alpha.,6.alpha.(E)]-")
