CID 9588742

3-pyridinecarboxaldehyde, 1,2,5,6-tetrahydro-1-cyclopentyl-, o-methyloxime, monohydrochloride,(e)-

Structural Information

Molecular Formula
C12H20N2O
SMILES
CO/N=C/C1=CCCN(C1)C2CCCC2
InChI
InChI=1S/C12H20N2O/c1-15-13-9-11-5-4-8-14(10-11)12-6-2-3-7-12/h5,9,12H,2-4,6-8,10H2,1H3/b13-9+
InChIKey
UOKBJPJUGUIZIB-UKTHLTGXSA-N
Compound name
(E)-1-(1-cyclopentyl-3,6-dihydro-2H-pyridin-5-yl)-N-methoxymethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

208.15756 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.16484 148.9
[M+Na]+ 231.14678 152.8
[M-H]- 207.15028 154.2
[M+NH4]+ 226.19138 168.1
[M+K]+ 247.12072 151.2
[M+H-H2O]+ 191.15482 140.6
[M+HCOO]- 253.15576 170.5
[M+CH3COO]- 267.17141 189.1
[M+Na-2H]- 229.13223 151.5
[M]+ 208.15701 144.9
[M]- 208.15811 144.9
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

No patent data available for this compound.