CID 154859

N2-hydroxy-2-amino-3-methyl-9h-pyrido(2,3-b)indole

Structural Information

Molecular Formula
C12H11N3O
SMILES
CC1=CC2=C(NC3=CC=CC=C32)N=C1NO
InChI
InChI=1S/C12H11N3O/c1-7-6-9-8-4-2-3-5-10(8)13-12(9)14-11(7)15-16/h2-6,16H,1H3,(H2,13,14,15)
InChIKey
VQFWOOZJALLVRG-UHFFFAOYSA-N
Compound name
N-(3-methyl-9H-pyrido[2,3-b]indol-2-yl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09021 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.097486 143.5
[M+Na]+ 236.079428 154.6
[M-H]- 212.082934 145.0
[M+NH4]+ 231.124033 162.5
[M+K]+ 252.053368 148.7
[M+H-H2O]+ 196.087470 136.8
[M+HCOO]- 258.088411 164.7
[M+CH3COO]- 272.104061 156.4
[M+Na-2H]- 234.064876 152.3
[M]+ 213.08966142 143.8
[M]- 213.09075858 143.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.