CID 4118312

114165-03-6

Structural Information

Molecular Formula
C10H9N3O
SMILES
C1=CC=C2C(=C1)C=C(C=N2)NNC=O
InChI
InChI=1S/C10H9N3O/c14-7-12-13-9-5-8-3-1-2-4-10(8)11-6-9/h1-7,13H,(H,12,14)
InChIKey
NYANIMJIUIFABV-UHFFFAOYSA-N
Compound name
N-(quinolin-3-ylamino)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.07455 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.08183 135.4
[M+Na]+ 210.06377 143.3
[M-H]- 186.06727 138.7
[M+NH4]+ 205.10837 154.1
[M+K]+ 226.03771 140.0
[M+H-H2O]+ 170.07181 128.0
[M+HCOO]- 232.07275 160.8
[M+CH3COO]- 246.08840 186.5
[M+Na-2H]- 208.04922 146.7
[M]+ 187.07400 134.7
[M]- 187.07510 134.7
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.