| SpectraBase Spectrum ID |
EKYqZGiuSyJ |
| Name |
Spiro[bicyclo[2.2.1]heptane-2,2'-[1,3]dioxolane], 7-(iodomethyl)-1,7-dimethyl-, [1R-(1.alpha.,4.alpha.,7S*)]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.042974850 u |
| Formula |
C12H19IO2 |
| InChI |
InChI=1S/C12H19IO2/c1-10(8-13)9-3-4-11(10,2)12(7-9)14-5-6-15-12/h9H,3-8H2,1-2H3 |
| InChIKey |
DEVSTPQUESDBFQ-UHFFFAOYSA-N |
| Molecular Weight |
322.186 g/mol |
| SMILES |
C12(C3(C(CI)(C)C(C2)CC3)C)OCCO1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94657 |
![Spiro[bicyclo[2.2.1]heptane-2,2'-[1,3]dioxolane], 7-(iodomethyl)-1,7-dimethyl-, [1R-(1.alpha.,4.alpha.,7S*)]-](/api/spectrum/EKYqZGiuSyJ/structure.png?h=300&w=458 "Spiro[bicyclo[2.2.1]heptane-2,2'-[1,3]dioxolane], 7-(iodomethyl)-1,7-dimethyl-, [1R-(1.alpha.,4.alpha.,7S*)]-")
