CID 9570629

Uc 46207

Structural Information

Molecular Formula
C6H10N2O2S2
SMILES
CNC(=O)O/N=C/1\CSCCS1
InChI
InChI=1S/C6H10N2O2S2/c1-7-6(9)10-8-5-4-11-2-3-12-5/h2-4H2,1H3,(H,7,9)/b8-5+
InChIKey
KPINHOMFRQMSJA-VMPITWQZSA-N
Compound name
[(E)-1,4-dithian-2-ylideneamino] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.01837 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.025646 140.4
[M+Na]+ 229.007588 144.9
[M-H]- 205.011094 144.0
[M+NH4]+ 224.052193 159.4
[M+K]+ 244.981528 142.5
[M+H-H2O]+ 189.015630 133.7
[M+HCOO]- 251.016571 153.3
[M+CH3COO]- 265.032221 185.5
[M+Na-2H]- 226.993036 142.3
[M]+ 206.01782142 138.7
[M]- 206.01891858 138.7
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.