| SpectraBase Spectrum ID |
9khZ2umwIaq |
| Name |
(5R,6R)-1,3-bis(chloranyl)-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H6Cl2N2S |
| InChI |
InChI=1S/C10H6Cl2N2S/c11-9-7-1-5(3-13)6(4-14)2-8(7)10(12)15-9/h5-6H,1-2H2/t5-,6-/m0/s1 |
| InChIKey |
XIKFWQZCBQQHPC-WDSKDSINSA-N |
| Molecular Weight |
257.138 g/mol |
| SMILES |
c12c(c(Cl)sc2Cl)C[C@]([C@@](C1)(C#N)[H])(C#N)[H] |
| SPLASH |
splash10-0a6r-0590000000-d0d38b4f8f38cbf54654 |
| Source of Spectrum |
F-67-9274-10 |
| Synonyms |
(5R,6R)-1,3-dichloro-4,5,6,7-tetrahydro-2-benzothiophene-5,6-dicarbonitrile
(5R,6R)-1,3-dichloro-4,5,6,7-tetrahydroisobenzothiophene-5,6-dicarbonitrile |
| Wiley ID |
1571430 |
