| SpectraBase Spectrum ID |
62lKJAxKR0l |
| Name |
1,3-Dioxolane, 4-[bis(ethylthio)methyl]-5-(4-methoxyphenyl)-2,2-dimethyl-, cis-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.132337042 u |
| Formula |
C17H26O3S2 |
| InChI |
InChI=1S/C17H26O3S2/c1-6-21-16(22-7-2)15-14(19-17(3,4)20-15)12-8-10-13(18-5)11-9-12/h8-11,14-16H,6-7H2,1-5H3/t14-,15-/m0/s1 |
| InChIKey |
YXUMBJMTCDAUEE-GJZGRUSLSA-N |
| Molecular Weight |
342.512 g/mol |
| SMILES |
[C@@]1([C@@](OC(O1)(C)C)(C1=CC=C(C=C1)OC)[H])(C(SCC)SCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971986 |
![1,3-Dioxolane, 4-[bis(ethylthio)methyl]-5-(4-methoxyphenyl)-2,2-dimethyl-, cis-(.+-.)-](/api/spectrum/62lKJAxKR0l/structure.png?h=300&w=458 "1,3-Dioxolane, 4-[bis(ethylthio)methyl]-5-(4-methoxyphenyl)-2,2-dimethyl-, cis-(.+-.)-")
