CID 11095863

3-amino-4-(boc-amino)pyridine

Structural Information

Molecular Formula
C10H15N3O2
SMILES
CC(C)(C)OC(=O)NC1=C(C=NC=C1)N
InChI
InChI=1S/C10H15N3O2/c1-10(2,3)15-9(14)13-8-4-5-12-6-7(8)11/h4-6H,11H2,1-3H3,(H,12,13,14)
InChIKey
UVAXTPFOVJAXHO-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-aminopyridin-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

209.11642 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.12370 147.5
[M+Na]+ 232.10564 154.3
[M-H]- 208.10914 149.7
[M+NH4]+ 227.15024 164.5
[M+K]+ 248.07958 153.0
[M+H-H2O]+ 192.11368 140.7
[M+HCOO]- 254.11462 170.0
[M+CH3COO]- 268.13027 189.7
[M+Na-2H]- 230.09109 153.6
[M]+ 209.11587 146.9
[M]- 209.11697 146.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe