CID 105520871

1781357-41-2

Structural Information

Molecular Formula
C14H22N4O2
SMILES
CC(C)(C)OC(=O)N1CCC2(C1)C3=C(CCN2)NC=N3
InChI
InChI=1S/C14H22N4O2/c1-13(2,3)20-12(19)18-7-5-14(8-18)11-10(4-6-17-14)15-9-16-11/h9,17H,4-8H2,1-3H3,(H,15,16)
InChIKey
SYPPZHWZYJYVER-UHFFFAOYSA-N
Compound name
tert-butyl spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4,3'-pyrrolidine]-1'-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.1743 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.18158 166.0
[M+Na]+ 301.16352 173.0
[M+NH4]+ 296.20812 172.8
[M+K]+ 317.13746 171.6
[M-H]- 277.16702 163.6
[M+Na-2H]- 299.14897 168.2
[M]+ 278.17375 165.9
[M]- 278.17485 165.9
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.