CID 9588772

1,2,5,6-tetrahydro-3-pyridinecarboxaldehyde oxime, monohydrochloride

Structural Information

Molecular Formula
C6H10N2O
SMILES
C1CNCC(=C1)/C=N/O
InChI
InChI=1S/C6H10N2O/c9-8-5-6-2-1-3-7-4-6/h2,5,7,9H,1,3-4H2/b8-5+
InChIKey
QGMSPDCKGXYZNB-VMPITWQZSA-N
Compound name
(NE)-N-(1,2,3,6-tetrahydropyridin-5-ylmethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

126.079315 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.08659 125.0
[M+Na]+ 149.06853 130.6
[M-H]- 125.07204 125.4
[M+NH4]+ 144.11314 144.6
[M+K]+ 165.04247 128.8
[M+H-H2O]+ 109.07658 118.7
[M+HCOO]- 171.07752 146.3
[M+CH3COO]- 185.09317 168.2
[M+Na-2H]- 147.05398 132.7
[M]+ 126.07877 119.4
[M]- 126.07986 119.4
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