CID 9588738

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

Structural Information

Molecular Formula
C11H20N2O
SMILES
CCCCN1CCC=C(C1)/C=N/OC
InChI
InChI=1S/C11H20N2O/c1-3-4-7-13-8-5-6-11(10-13)9-12-14-2/h6,9H,3-5,7-8,10H2,1-2H3/b12-9+
InChIKey
GANMYIVIUUOENA-FMIVXFBMSA-N
Compound name
(E)-1-(1-butyl-3,6-dihydro-2H-pyridin-5-yl)-N-methoxymethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

196.15756 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.16484 146.8
[M+Na]+ 219.14678 157.5
[M+NH4]+ 214.19138 154.8
[M+K]+ 235.12072 150.3
[M-H]- 195.15028 149.0
[M+Na-2H]- 217.13223 152.3
[M]+ 196.15701 148.7
[M]- 196.15811 148.7
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