| SpectraBase Spectrum ID |
2i6UC1GmQUd |
| Name |
2-(4-oxidanylidene-2-propylsulfanyl-quinazolin-3-yl)ethanenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13N3OS |
| InChI |
InChI=1S/C13H13N3OS/c1-2-9-18-13-15-11-6-4-3-5-10(11)12(17)16(13)8-7-14/h3-6H,2,8-9H2,1H3 |
| InChIKey |
ANNQCGKBBLPZAD-UHFFFAOYSA-N |
| Molecular Weight |
259.327 g/mol |
| SMILES |
C=1(N(C(c2c(N1)cccc2)=O)CC#N)SCCC |
| SPLASH |
splash10-014i-0090000000-1d146399e9667786803d |
| Source of Spectrum |
Y-38-420-4 |
| Synonyms |
2-(4-oxo-2-propylsulfanyl-quinazolin-3-yl)acetonitrile
2-[4-keto-2-(propylthio)quinazolin-3-yl]acetonitrile
2-[4-oxo-2-(propylthio)-3-quinazolinyl]acetonitrile |
| Wiley ID |
848426 |
