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]+ 303.062026 165.9
[M+Na]+ 325.043968 171.7
[M-H]- 301.047474 171.8
[M+NH4]+ 320.088573 180.7
[M+K]+ 341.017908 165.0
[M+H-H2O]+ 285.052010 158.2
[M+HCOO]- 347.052951 179.4
[M+CH3COO]- 361.068601 204.2
[M+Na-2H]- 323.029416 167.3
[M]+ 302.05420142 165.8
[M]- 302.05529858 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.