CID 9588665

(quinolinyl-4)oxy-2 propionamidoxime dichlorhydrate [french]

Structural Information

Molecular Formula
C12H13N3O2
SMILES
CC(/C(=N\O)/N)OC1=CC=NC2=CC=CC=C21
InChI
InChI=1S/C12H13N3O2/c1-8(12(13)15-16)17-11-6-7-14-10-5-3-2-4-9(10)11/h2-8,16H,1H3,(H2,13,15)
InChIKey
JEIPCFMOHNACSX-UHFFFAOYSA-N
Compound name
N'-hydroxy-2-quinolin-4-yloxypropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.10077 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.108046 149.7
[M+Na]+ 254.089988 156.1
[M-H]- 230.093494 152.3
[M+NH4]+ 249.134593 166.2
[M+K]+ 270.063928 153.6
[M+H-H2O]+ 214.098030 141.9
[M+HCOO]- 276.098971 171.9
[M+CH3COO]- 290.114621 195.3
[M+Na-2H]- 252.075436 156.4
[M]+ 231.10022142 148.7
[M]- 231.10131858 148.7
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.