CID 3056539

Methylpropylarsinic acid

Structural Information

Molecular Formula
C4H11AsO2
SMILES
CCC[As](=O)(C)O
InChI
InChI=1S/C4H11AsO2/c1-3-4-5(2,6)7/h3-4H2,1-2H3,(H,6,7)
InChIKey
BSFPFOQSGBQFMD-UHFFFAOYSA-N
Compound name
methyl(propyl)arsinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.9975 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.00478 131.2
[M+Na]+ 188.98672 138.8
[M-H]- 164.99022 130.2
[M+NH4]+ 184.03132 153.4
[M+K]+ 204.96066 138.3
[M+H-H2O]+ 148.99476 127.3
[M+HCOO]- 210.99570 152.4
[M+CH3COO]- 225.01135 167.0
[M+Na-2H]- 186.97217 137.9
[M]+ 165.99695 132.0
[M]- 165.99805 132.0
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.