| SpectraBase Spectrum ID |
559QnTIz0B3 |
| Name |
Spiro[bicyclo[3.3.1]non-7-ene-3,2'-[1,3]dioxolan]-6-one, 7-(5-hexenyl)-8-hydroxy-9,9-dimethyl-, (.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.198759378 u |
| Formula |
C19H28O4 |
| InChI |
InChI=1S/C19H28O4/c1-4-5-6-7-8-13-16(20)14-11-19(22-9-10-23-19)12-15(17(13)21)18(14,2)3/h4,13-15H,1,5-12H2,2-3H3/t13?,14-,15+ |
| InChIKey |
CXCQBRQIMBGCKH-GOOCMWNKSA-N |
| Molecular Weight |
320.429 g/mol |
| SMILES |
[C@]12(C([C@](CC3(C2)OCCO3)(C(C(C1=O)CCCCC=C)=O)[H])(C)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.800638 |
![Spiro[bicyclo[3.3.1]non-7-ene-3,2'-[1,3]dioxolan]-6-one, 7-(5-hexenyl)-8-hydroxy-9,9-dimethyl-, (.+-.)-](/api/spectrum/559QnTIz0B3/structure.png?h=300&w=458 "Spiro[bicyclo[3.3.1]non-7-ene-3,2'-[1,3]dioxolan]-6-one, 7-(5-hexenyl)-8-hydroxy-9,9-dimethyl-, (.+-.)-")
