CID 9588774

3-pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-methyl-, oxime, monohydrochloride, (e)-

Structural Information

Molecular Formula
C7H12N2O
SMILES
CN1CCC=C(C1)/C=N/O
InChI
InChI=1S/C7H12N2O/c1-9-4-2-3-7(6-9)5-8-10/h3,5,10H,2,4,6H2,1H3/b8-5+
InChIKey
ZHOXJNSISQLYMZ-VMPITWQZSA-N
Compound name
(NE)-N-[(1-methyl-3,6-dihydro-2H-pyridin-5-yl)methylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

140.09496 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.102236 128.8
[M+Na]+ 163.084178 135.4
[M-H]- 139.087684 130.8
[M+NH4]+ 158.128783 148.9
[M+K]+ 179.058118 134.2
[M+H-H2O]+ 123.092220 122.4
[M+HCOO]- 185.093161 151.3
[M+CH3COO]- 199.108811 175.0
[M+Na-2H]- 161.069626 135.7
[M]+ 140.09441142 125.9
[M]- 140.09550858 125.9
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