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]+ 207.02565 140.4
[M+Na]+ 229.00759 144.9
[M-H]- 205.01109 144.0
[M+NH4]+ 224.05219 159.4
[M+K]+ 244.98153 142.5
[M+H-H2O]+ 189.01563 133.7
[M+HCOO]- 251.01657 153.3
[M+CH3COO]- 265.03222 185.5
[M+Na-2H]- 226.99304 142.3
[M]+ 206.01782 138.7
[M]- 206.01892 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.