| SpectraBase Spectrum ID |
HmXBRCvRdak |
| Name |
2H-1-Benzothiopyran-4-carbonitrile, 3,4-dihydro-2,3-dimethyl-, (2.alpha.,3.alpha.,4.beta.)- |
| CAS Registry Number |
120850-81-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NS |
| InChI |
InChI=1S/C12H13NS/c1-8-9(2)14-12-6-4-3-5-10(12)11(8)7-13/h3-6,8-9,11H,1-2H3/t8-,9+,11+/m1/s1 |
| InChIKey |
MRFNFKCPVGTVNP-YWVKMMECSA-N |
| Molecular Weight |
203.303 g/mol |
| SMILES |
c12S[C@]([C@]([C@@](c2cccc1)(C#N)[H])(C)[H])(C)[H] |
| SPLASH |
splash10-0udi-0980000000-56e61762cb2fa6efc64a |
| Source of Spectrum |
KC-1988-3379-12 |
| Synonyms |
(2S,3S,4S)-2,3-dimethyl-3,4-dihydro-2H-1-benzothiopyran-4-carbonitrile
trans,trans-2,3-dimethylthiochroman-4-carbonitrile |
| Wiley ID |
1200937 |
