CID 22499486

301225-52-5

Structural Information

Molecular Formula
C15H23N3O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)NC2=CN=CC=C2
InChI
InChI=1S/C15H23N3O2/c1-15(2,3)20-14(19)18-9-6-12(7-10-18)17-13-5-4-8-16-11-13/h4-5,8,11-12,17H,6-7,9-10H2,1-3H3
InChIKey
SGWSPSSRJWXVTE-UHFFFAOYSA-N
Compound name
tert-butyl 4-(pyridin-3-ylamino)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

277.17902 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.18630 167.7
[M+Na]+ 300.16824 171.3
[M-H]- 276.17174 170.6
[M+NH4]+ 295.21284 180.4
[M+K]+ 316.14218 168.9
[M+H-H2O]+ 260.17628 158.6
[M+HCOO]- 322.17722 183.8
[M+CH3COO]- 336.19287 200.0
[M+Na-2H]- 298.15369 171.7
[M]+ 277.17847 164.3
[M]- 277.17957 164.3
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