| SpectraBase Spectrum ID |
CaEH4ekUoeH |
| Name |
1-Butanone, 1-(4H-1,4-benzothiazin-2-yl)- |
| Alternate Name(s) |
1-(4H-1,4-benzothiazin-2-yl)-1-butanone
2-Butyryl-4H-1,4-benzothiazine
4H-1,4-benzothiazine, 1-butanone deriv. |
| CAS Registry Number |
86333-18-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NOS |
| InChI |
InChI=1S/C12H13NOS/c1-2-5-10(14)12-8-13-9-6-3-4-7-11(9)15-12/h3-4,6-8,13H,2,5H2,1H3 |
| InChIKey |
HYYMOGSRCBZSED-UHFFFAOYSA-N |
| Molecular Weight |
219.302 g/mol |
| SMILES |
N1c2ccccc2SC(=C1)C(=O)CCC |
| SPLASH |
splash10-014j-0590000000-33f40942647744252997 |
| Source of Spectrum |
KC-1983-570-0 |
| Wiley ID |
1218788 |
