CID 14914072

67591-44-0

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1=CC(=CC(=C1)NO)N
InChI
InChI=1S/C6H8N2O/c7-5-2-1-3-6(4-5)8-9/h1-4,8-9H,7H2
InChIKey
JVHBXOJOULTNAI-UHFFFAOYSA-N
Compound name
N-(3-aminophenyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

124.06366 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.070936 121.5
[M+Na]+ 147.052878 129.0
[M-H]- 123.056384 123.9
[M+NH4]+ 142.097483 142.4
[M+K]+ 163.026818 127.0
[M+H-H2O]+ 107.060920 116.1
[M+HCOO]- 169.061861 147.2
[M+CH3COO]- 183.077511 171.9
[M+Na-2H]- 145.038326 129.7
[M]+ 124.06311142 117.8
[M]- 124.06420858 117.8
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

patents stripe