CID 132342023

2138426-84-1

Structural Information

Molecular Formula
C15H24N4O2
SMILES
CC(C)(C)OC(=O)NC1CCN(C1)C2=CC=CC(=N2)CN
InChI
InChI=1S/C15H24N4O2/c1-15(2,3)21-14(20)18-12-7-8-19(10-12)13-6-4-5-11(9-16)17-13/h4-6,12H,7-10,16H2,1-3H3,(H,18,20)
InChIKey
JDQUEUKCSBQZMC-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-[6-(aminomethyl)pyridin-2-yl]pyrrolidin-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.1899 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.19718 171.1
[M+Na]+ 315.17912 175.6
[M-H]- 291.18262 174.4
[M+NH4]+ 310.22372 184.9
[M+K]+ 331.15306 173.1
[M+H-H2O]+ 275.18716 162.5
[M+HCOO]- 337.18810 189.9
[M+CH3COO]- 351.20375 205.2
[M+Na-2H]- 313.16457 172.6
[M]+ 292.18935 168.6
[M]- 292.19045 168.6
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.