| SpectraBase Spectrum ID |
BjnWgWPDu4R |
| Name |
o-Methyl-hydrogen-(4-methoxyphenyl)-phosphonothioate-dicyclohexylamonium-salt |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.184052063 u |
| Formula |
C20H32NO3PS |
| InChI |
InChI=1S/C20H32NO3PS/c1-22-19-13-15-20(16-14-19)25(26,23-2)24-21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h13-18H,3-12H2,1-2H3 |
| InChIKey |
GNECZDJHZSRSHG-UHFFFAOYSA-N |
| Molecular Weight |
397.514 g/mol |
| SMILES |
C1(OC)=CC=C(P(=S)(OC)ON(C2CCCCC2)C2CCCCC2)C=C1 |
