CID 94994

Arsine, 4-carbamidophenyloxo-

Structural Information

Molecular Formula
C7H7AsN2O2
SMILES
C1=CC(=CC=C1NC(=O)N)[As]=O
InChI
InChI=1S/C7H7AsN2O2/c9-7(11)10-6-3-1-5(8-12)2-4-6/h1-4H,(H3,9,10,11)
InChIKey
WWXFAARCKPTHAQ-UHFFFAOYSA-N
Compound name
(4-arsorosophenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

225.97235 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.97963 143.2
[M+Na]+ 248.96157 150.1
[M-H]- 224.96507 146.3
[M+NH4]+ 244.00617 162.4
[M+K]+ 264.93551 148.0
[M+H-H2O]+ 208.96961 136.4
[M+HCOO]- 270.97055 168.8
[M+CH3COO]- 284.98620 183.2
[M+Na-2H]- 246.94702 148.3
[M]+ 225.97180 141.3
[M]- 225.97290 141.3
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.