CID 6510086

81892-51-5

Structural Information

Molecular Formula
C12H14FN3O2
SMILES
CN(C)C(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)F
InChI
InChI=1S/C12H14FN3O2/c1-15(2)12(17)16-6-5-10(14-18)9-7-8(13)3-4-11(9)16/h3-4,7,18H,5-6H2,1-2H3/b14-10-
InChIKey
CNLSVGAHIXRIEE-UVTDQMKNSA-N
Compound name
(4Z)-6-fluoro-4-hydroxyimino-N,N-dimethyl-2,3-dihydroquinoline-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

251.10701 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.114286 154.0
[M+Na]+ 274.096228 161.2
[M-H]- 250.099734 157.3
[M+NH4]+ 269.140833 171.2
[M+K]+ 290.070168 159.4
[M+H-H2O]+ 234.104270 145.6
[M+HCOO]- 296.105211 174.6
[M+CH3COO]- 310.120861 202.0
[M+Na-2H]- 272.081676 158.1
[M]+ 251.10646142 151.9
[M]- 251.10755858 151.9
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

patents stripe