| SpectraBase Spectrum ID |
JDGhced5Um8 |
| Name |
Chlormezanone |
| CAS Registry Number |
80-77-3 |
| Collision Energy |
45 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
273.022642121 u |
| Formula |
C11H12ClNO3S |
| InChI |
InChI=1S/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3 |
| InChIKey |
WEQAYVWKMWHEJO-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
P |
| Ionization Type |
ESI+ |
| Molecular Weight |
273.734 g/mol |
| Nominal Mass |
273 u |
| Precursor Ion |
[M+H]+ |
| Precursor m/z |
274.03 |
| SMILES |
C1(Cl)=CC=C(C2S(=O)(=O)CCC(=O)N2C)C=C1 |
| Selected Ion Charge |
1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
2-(4-chlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_+_194.15 |
