CID 9588650

85475-51-0

Structural Information

Molecular Formula
C12H15N3O2
SMILES
CC(/C(=N/O)/N)N1C(=O)CCC2=CC=CC=C21
InChI
InChI=1S/C12H15N3O2/c1-8(12(13)14-17)15-10-5-3-2-4-9(10)6-7-11(15)16/h2-5,8,17H,6-7H2,1H3,(H2,13,14)
InChIKey
FVPYGEUNIULMSJ-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-(2-oxo-3,4-dihydroquinolin-1-yl)propanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.11642 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.123696 151.3
[M+Na]+ 256.105638 156.9
[M-H]- 232.109144 153.6
[M+NH4]+ 251.150243 167.9
[M+K]+ 272.079578 154.4
[M+H-H2O]+ 216.113680 144.0
[M+HCOO]- 278.114621 170.8
[M+CH3COO]- 292.130271 196.4
[M+Na-2H]- 254.091086 155.3
[M]+ 233.11587142 147.2
[M]- 233.11696858 147.2
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.