CID 16072476

N-[(z)-4-quinolylmethyleneamino]acetamide

Structural Information

Molecular Formula
C12H11N3O
SMILES
CC(=O)N/N=C\C1=CC=NC2=CC=CC=C12
InChI
InChI=1S/C12H11N3O/c1-9(16)15-14-8-10-6-7-13-12-5-3-2-4-11(10)12/h2-8H,1H3,(H,15,16)/b14-8-
InChIKey
TZYCIBBXRLTDLO-ZSOIEALJSA-N
Compound name
N-[(Z)-quinolin-4-ylmethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

213.09021 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.097486 144.8
[M+Na]+ 236.079428 152.4
[M-H]- 212.082934 149.3
[M+NH4]+ 231.124033 163.2
[M+K]+ 252.053368 149.4
[M+H-H2O]+ 196.087470 136.9
[M+HCOO]- 258.088411 170.2
[M+CH3COO]- 272.104061 193.8
[M+Na-2H]- 234.064876 154.2
[M]+ 213.08966142 145.1
[M]- 213.09075858 145.1
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.