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]+ 209.164836 148.9
[M+Na]+ 231.146778 152.8
[M-H]- 207.150284 154.2
[M+NH4]+ 226.191383 168.1
[M+K]+ 247.120718 151.2
[M+H-H2O]+ 191.154820 140.6
[M+HCOO]- 253.155761 170.5
[M+CH3COO]- 267.171411 189.1
[M+Na-2H]- 229.132226 151.5
[M]+ 208.15701142 144.9
[M]- 208.15810858 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.