CID 12397504

65092-21-9

Structural Information

Molecular Formula
C12H18N4O
SMILES
CC(=O)N1CCC2(CC1)C3=C(CCN2)NC=N3
InChI
InChI=1S/C12H18N4O/c1-9(17)16-6-3-12(4-7-16)11-10(2-5-15-12)13-8-14-11/h8,15H,2-7H2,1H3,(H,13,14)
InChIKey
SUFIBPJTUVGMDL-UHFFFAOYSA-N
Compound name
1-spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4,4'-piperidine]-1'-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.14806 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.155336 157.7
[M+Na]+ 257.137278 163.3
[M-H]- 233.140784 155.3
[M+NH4]+ 252.181883 173.4
[M+K]+ 273.111218 158.5
[M+H-H2O]+ 217.145320 148.6
[M+HCOO]- 279.146261 167.2
[M+CH3COO]- 293.161911 166.2
[M+Na-2H]- 255.122726 160.4
[M]+ 234.14751142 148.4
[M]- 234.14860858 148.4
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

No patent data available for this compound.