CID 154699631

Ns00117385

Structural Information

Molecular Formula
C18H15N3O
SMILES
CC1=NC=CC2=C1N(C3=CC=CC=C23)C4=CC=C(C=C4)NO
InChI
InChI=1S/C18H15N3O/c1-12-18-16(10-11-19-12)15-4-2-3-5-17(15)21(18)14-8-6-13(20-22)7-9-14/h2-11,20,22H,1H3
InChIKey
HDGKCLSJGPSPQX-UHFFFAOYSA-N
Compound name
N-[4-(1-methylpyrido[3,4-b]indol-9-yl)phenyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

289.12152 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.128796 165.5
[M+Na]+ 312.110738 176.4
[M-H]- 288.114244 171.3
[M+NH4]+ 307.155343 181.6
[M+K]+ 328.084678 169.4
[M+H-H2O]+ 272.118780 156.6
[M+HCOO]- 334.119721 187.3
[M+CH3COO]- 348.135371 177.5
[M+Na-2H]- 310.096186 172.9
[M]+ 289.12097142 167.3
[M]- 289.12206858 167.3
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.