| SpectraBase Spectrum ID |
2H99CaYN9Xh |
| Name |
PHOSALONE |
| CAS Registry Number |
2310-17-0 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
366.986865009 u |
| Formula |
C12H15ClNO4PS2 |
| InChI |
InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3 |
| InChIKey |
IOUNQDKNJZEDEP-UHFFFAOYSA-N |
| Molecular Weight |
367.802 g/mol |
| Nominal Mass |
367 u |
| Number of Peaks |
129 |
| SMILES |
CCOP(OCC)(=S)SCN1c2ccc(cc2OC1=O)Cl |
| SPLASH |
splash10-001i-1901000000-64992f485affccfc8724 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
S-[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl] O,O-diethyl dithiophosphate |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4090 |
