CID 21128679

33918-12-6

Structural Information

Molecular Formula
C6H13N2O2PS2
SMILES
CN\1CCS/C1=N\P(=O)(OC)SC
InChI
InChI=1S/C6H13N2O2PS2/c1-8-4-5-13-6(8)7-11(9,10-2)12-3/h4-5H2,1-3H3/b7-6-
InChIKey
IXWHMMCVLSCIAL-SREVYHEPSA-N
Compound name
(Z)-N-[methoxy(methylsulfanyl)phosphoryl]-3-methyl-1,3-thiazolidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.01561 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.02289 145.6
[M+Na]+ 263.00483 152.9
[M-H]- 239.00833 147.9
[M+NH4]+ 258.04943 165.3
[M+K]+ 278.97877 151.2
[M+H-H2O]+ 223.01287 137.1
[M+HCOO]- 285.01381 164.3
[M+CH3COO]- 299.02946 191.7
[M+Na-2H]- 260.99028 143.6
[M]+ 240.01506 149.0
[M]- 240.01616 149.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.