CID 14366091

Urea, n-(((dimethylamino)thioxomethyl)thio)-n'-phenyl-

Structural Information

Molecular Formula
C10H13N3OS2
SMILES
CN(C)C(=S)SNC(=O)NC1=CC=CC=C1
InChI
InChI=1S/C10H13N3OS2/c1-13(2)10(15)16-12-9(14)11-8-6-4-3-5-7-8/h3-7H,1-2H3,(H2,11,12,14)
InChIKey
PGINXCCSVDJQLZ-UHFFFAOYSA-N
Compound name
(phenylcarbamoylamino) N,N-dimethylcarbamodithioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

255.05 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.05728 154.2
[M+Na]+ 278.03922 161.6
[M+NH4]+ 273.08382 161.9
[M+K]+ 294.01316 153.4
[M-H]- 254.04272 157.2
[M+Na-2H]- 276.02467 159.1
[M]+ 255.04945 156.7
[M]- 255.05055 156.7
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

patents stripe