| SpectraBase Spectrum ID |
c4fQnWqOD6 |
| Name |
Benzenecarbothioic acid, S-[3-(phenylseleno)bicyclo[2.2.1]hept-2-yl]ester, (2-exo,3-endo)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.040008437 u |
| Formula |
C20H20OSSe |
| InChI |
InChI=1S/C20H20OSSe/c22-20(14-7-3-1-4-8-14)21-18-15-11-12-16(13-15)19(18)23-17-9-5-2-6-10-17/h1-10,15-16,18-19H,11-13H2/t15-,16-,18?,19-/m0/s1 |
| InChIKey |
DYJLOOWBHWEMQH-TZEXOCCPSA-N |
| Molecular Weight |
387.411 g/mol |
| SMILES |
C1([C@](C2C[C@@]1(CC2)[H])([Se]C=1C=CC=CC1)[H])OC(=S)C1=CC=CC=C1 |
![Benzenecarbothioic acid, S-[3-(phenylseleno)bicyclo[2.2.1]hept-2-yl]ester, (2-exo,3-endo)-](/api/spectrum/c4fQnWqOD6/structure.png?h=300&w=458 "Benzenecarbothioic acid, S-[3-(phenylseleno)bicyclo[2.2.1]hept-2-yl]ester, (2-exo,3-endo)-")
