CID 46839

64048-94-8

Structural Information

Molecular Formula
C8H10AsNO3
SMILES
C1=CC(=C(C=C1[As]=O)N)OCCO
InChI
InChI=1S/C8H10AsNO3/c10-7-5-6(9-12)1-2-8(7)13-4-3-11/h1-2,5,11H,3-4,10H2
InChIKey
ULYJKALLWCFWKP-UHFFFAOYSA-N
Compound name
2-(2-amino-4-arsorosophenoxy)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.98766 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.99494 147.6
[M+Na]+ 265.97688 155.2
[M-H]- 241.98038 149.4
[M+NH4]+ 261.02148 166.0
[M+K]+ 281.95082 152.7
[M+H-H2O]+ 225.98492 141.1
[M+HCOO]- 287.98586 171.2
[M+CH3COO]- 302.00151 182.7
[M+Na-2H]- 263.96233 151.9
[M]+ 242.98711 148.2
[M]- 242.98821 148.2
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.