CID 3038022

Oxamide, n-(p-methoxyphenyl)-n'-phenyldithio-

Structural Information

Molecular Formula
C15H14N2OS2
SMILES
COC1=CC=C(C=C1)NC(=S)C(=S)NC2=CC=CC=C2
InChI
InChI=1S/C15H14N2OS2/c1-18-13-9-7-12(8-10-13)17-15(20)14(19)16-11-5-3-2-4-6-11/h2-10H,1H3,(H,16,19)(H,17,20)
InChIKey
JOCOLCMMJIJABA-UHFFFAOYSA-N
Compound name
N'-(4-methoxyphenyl)-N-phenylethanedithioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.05475 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.06203 165.9
[M+Na]+ 325.04397 171.7
[M-H]- 301.04747 171.8
[M+NH4]+ 320.08857 180.7
[M+K]+ 341.01791 165.0
[M+H-H2O]+ 285.05201 158.2
[M+HCOO]- 347.05295 179.4
[M+CH3COO]- 361.06860 204.2
[M+Na-2H]- 323.02942 167.3
[M]+ 302.05420 165.8
[M]- 302.05530 165.8
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.