| Properties | Image |
MNX_ID | MNXM167734 |
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reference | sabiorkM:29741 |
formula | C10H15O5PS2 |
global charge | 0 |
mol weight | 310.333 |
InChIKey | ZDHYERRNXRANLI-UHFFFAOYSA-N |
InChI | InChI=1S/C10H15O5PS2/c1-8-7-9(15-16(17,13-2)14-3)5-6-10(8)18(4,11)12/h5-7H,1-4H3 |
SMILES | COP(=S)(OC)OC1=CC(C)=C(S(C)(=O)=O)C=C1 |
MNX internals
InChI (mnx) | InChI=1/C10H15O5PS2/c1-8-7-9(15-16(17,13-2)14-3)5-6-10(8)18(4,11)12/h5-7H,1-4H3 |
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SMILES (mnx) | [CH3:1][C:8]1=[C:10]([S:18]([CH3:4])(=[O:11])=[O:12])[CH:6]=[CH:5][C:9]([O:15][P:16]([O:13][CH3:2])([O:14][CH3:3])=[S:17])=[CH:7]1 |
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