| SpectraBase Spectrum ID |
1dYBCacWgJD |
| Name |
2-[(1E,3E)-4-Methoxy-2-methyl-buta-1,3-dienyl]sulfanylpyridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
207.071785216 u |
| Formula |
C11H13NOS |
| InChI |
InChI=1S/C11H13NOS/c1-10(6-8-13-2)9-14-11-5-3-4-7-12-11/h3-9H,1-2H3/b8-6+,10-9+ |
| InChIKey |
RAOSOBGGAUFFRW-QGHYKFKQSA-N |
| Molecular Weight |
207.291 g/mol |
| SMILES |
C1(S\C=C\(\C=C\OC)C)=NC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96114 |
![2-[(1E,3E)-4-methoxy-2-methyl-buta-1,3-dienyl]sulfanylpyridine](/api/spectrum/1dYBCacWgJD/structure.png?h=300&w=458 "2-[(1E,3E)-4-methoxy-2-methyl-buta-1,3-dienyl]sulfanylpyridine")
