CID 237996

10-phenyl-10h-phenoxarsine 10-oxide

Structural Information

Molecular Formula
C18H13AsO2
SMILES
C1=CC=C(C=C1)[As]2(=O)C3=CC=CC=C3OC4=CC=CC=C24
InChI
InChI=1S/C18H13AsO2/c20-19(14-8-2-1-3-9-14)15-10-4-6-12-17(15)21-18-13-7-5-11-16(18)19/h1-13H
InChIKey
CXMPKTLKMFBEJG-UHFFFAOYSA-N
Compound name
10-phenylphenoxarsinine 10-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.01315 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.02043 172.0
[M+Na]+ 359.00237 181.0
[M-H]- 335.00587 180.8
[M+NH4]+ 354.04697 189.7
[M+K]+ 374.97631 176.3
[M+H-H2O]+ 319.01041 162.3
[M+HCOO]- 381.01135 191.6
[M+CH3COO]- 395.02700 183.7
[M+Na-2H]- 356.98782 181.1
[M]+ 336.01260 172.2
[M]- 336.01370 172.2
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.