CID 6510071

6-chloro-4-oximino-1-acetyl-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C11H11ClN2O2
SMILES
CC(=O)N1CC/C(=N/O)/C2=C1C=CC(=C2)Cl
InChI
InChI=1S/C11H11ClN2O2/c1-7(15)14-5-4-10(13-16)9-6-8(12)2-3-11(9)14/h2-3,6,16H,4-5H2,1H3/b13-10-
InChIKey
NJNLNQPIKSHXQP-RAXLEYEMSA-N
Compound name
1-[(4Z)-6-chloro-4-hydroxyimino-2,3-dihydroquinolin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

238.0509 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.05818 148.4
[M+Na]+ 261.04012 161.5
[M+NH4]+ 256.08472 156.7
[M+K]+ 277.01406 154.8
[M-H]- 237.04362 150.5
[M+Na-2H]- 259.02557 153.7
[M]+ 238.05035 151.0
[M]- 238.05145 151.0
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