CID 17933588

N-[(pyridin-3-yl)methyl]hydroxylamine dihydrochloride

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1=CC(=CN=C1)CNO
InChI
InChI=1S/C6H8N2O/c9-8-5-6-2-1-3-7-4-6/h1-4,8-9H,5H2
InChIKey
IPWMEKVTTTWYSW-UHFFFAOYSA-N
Compound name
N-(pyridin-3-ylmethyl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

124.06366 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.070936 122.1
[M+Na]+ 147.052878 129.5
[M-H]- 123.056384 123.1
[M+NH4]+ 142.097483 141.9
[M+K]+ 163.026818 127.7
[M+H-H2O]+ 107.060920 115.8
[M+HCOO]- 169.061861 146.1
[M+CH3COO]- 183.077511 169.0
[M+Na-2H]- 145.038326 131.9
[M]+ 124.06311142 120.2
[M]- 124.06420858 120.2
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.