| SpectraBase Spectrum ID |
7mXRnF2UqQ4 |
| Name |
(1R,2R,4R)-2-(3,3-Dimethyl-oxiranyl)-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.177630011 u |
| Formula |
C14H24O2 |
| InChI |
InChI=1S/C14H24O2/c1-11(2)9-6-7-13(11,5)14(15,8-9)10-12(3,4)16-10/h9-10,15H,6-8H2,1-5H3/t9-,10?,13-,14+/m1/s1 |
| InChIKey |
DDNYSFYXDVRGOK-HBUSVSKJSA-N |
| Molecular Weight |
224.344 g/mol |
| SMILES |
C1([C@@]2([C@]3(C(C)(C)[C@@](C2)(CC3)[H])C)O)OC1(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972143 |
![(1R,2R,4R)-2-(3,3-Dimethyl-oxiranyl)-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-ol](/api/spectrum/7mXRnF2UqQ4/structure.png?h=300&w=458 "(1R,2R,4R)-2-(3,3-Dimethyl-oxiranyl)-1,7,7-trimethyl-bicyclo[2.2.1]heptan-2-ol")
