CID 115104

115044-41-2

Structural Information

Molecular Formula
C11H11N5O
SMILES
CC1=CN=C2C=CC3=C(C2=N1)N=C(N3C)NO
InChI
InChI=1S/C11H11N5O/c1-6-5-12-7-3-4-8-10(9(7)13-6)14-11(15-17)16(8)2/h3-5,17H,1-2H3,(H,14,15)
InChIKey
FVNCCTJGBOTWTM-UHFFFAOYSA-N
Compound name
N-(3,8-dimethylimidazo[4,5-f]quinoxalin-2-yl)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

1
Patents

229.09636 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.103636 150.5
[M+Na]+ 252.085578 163.3
[M-H]- 228.089084 151.1
[M+NH4]+ 247.130183 167.0
[M+K]+ 268.059518 158.0
[M+H-H2O]+ 212.093620 142.2
[M+HCOO]- 274.094561 170.7
[M+CH3COO]- 288.110211 163.1
[M+Na-2H]- 250.071026 159.1
[M]+ 229.09581142 153.5
[M]- 229.09690858 153.5
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

patents stripe