| SpectraBase Spectrum ID |
BI6prd7q5pq |
| Name |
1',2'-dimethyl-4-spiro[1-benzothiopyran-2,4'-cyclopentene]carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15NS |
| InChI |
InChI=1S/C16H15NS/c1-11-7-16(8-12(11)2)9-13(10-17)14-5-3-4-6-15(14)18-16/h3-6,9H,7-8H2,1-2H3 |
| InChIKey |
KTODLPFVCZDXHF-UHFFFAOYSA-N |
| Molecular Weight |
253.363 g/mol |
| SMILES |
C12(Sc3ccccc3C(=C2)C#N)CC(C)=C(C1)C |
| SPLASH |
splash10-0006-9050000000-db28ca56ea60b8d68f10 |
| Source of Spectrum |
KC-0-2234-7 |
| Synonyms |
1,2-dimethylspiro[cyclopentene-4,2'-thiochromene]-4'-carbonitrile |
| Wiley ID |
786320 |
![1',2'-dimethyl-4-spiro[1-benzothiopyran-2,4'-cyclopentene]carbonitrile](/api/spectrum/BI6prd7q5pq/structure.png?h=300&w=458 "1',2'-dimethyl-4-spiro[1-benzothiopyran-2,4'-cyclopentene]carbonitrile")
