| SpectraBase Spectrum ID |
3OS5LvvB4A5 |
| Name |
7-Oxabicyclo[2.2.1]heptane, 2-(chloromethyl)-3-methylene-2-[(2-nitrophenyl)thio]-, exo-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.038292186 u |
| Formula |
C14H14ClNO3S |
| InChI |
InChI=1S/C14H14ClNO3S/c1-9-11-6-7-13(19-11)14(9,8-15)20-12-5-3-2-4-10(12)16(17)18/h2-5,11,13H,1,6-8H2 |
| InChIKey |
RIOVFAXGVBXEJC-UHFFFAOYSA-N |
| Molecular Weight |
311.783 g/mol |
| SMILES |
C1(C(C2OC1CC2)=C)(SC=1C(N(=O)=O)=CC=CC1)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932759 |
![7-Oxabicyclo[2.2.1]heptane, 2-(chloromethyl)-3-methylene-2-[(2-nitrophenyl)thio]-, exo-(.+-.)-](/api/spectrum/3OS5LvvB4A5/structure.png?h=300&w=458 "7-Oxabicyclo[2.2.1]heptane, 2-(chloromethyl)-3-methylene-2-[(2-nitrophenyl)thio]-, exo-(.+-.)-")
