CID 135491058

Quinolinaldehyde, oxime

Structural Information

Molecular Formula
C10H8N2O
SMILES
C1=CC=C2C(=C1)C=CC(=N2)/C=N/O
InChI
InChI=1S/C10H8N2O/c13-11-7-9-6-5-8-3-1-2-4-10(8)12-9/h1-7,13H/b11-7+
InChIKey
BOHDZKSQXXJHBO-YRNVUSSQSA-N
Compound name
(NE)-N-(quinolin-2-ylmethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

67
Patents

172.06366 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.070936 132.6
[M+Na]+ 195.052878 141.6
[M-H]- 171.056384 136.1
[M+NH4]+ 190.097483 152.5
[M+K]+ 211.026818 138.3
[M+H-H2O]+ 155.060920 125.7
[M+HCOO]- 217.061861 157.0
[M+CH3COO]- 231.077511 180.8
[M+Na-2H]- 193.038326 143.5
[M]+ 172.06311142 132.5
[M]- 172.06420858 132.5
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

patents stripe