CID 154879023

2138143-00-5

Structural Information

Molecular Formula
C13H22N4O2
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)N2C(=CC=N2)N
InChI
InChI=1S/C13H22N4O2/c1-13(2,3)19-12(18)16-8-4-5-10(9-16)17-11(14)6-7-15-17/h6-7,10H,4-5,8-9,14H2,1-3H3
InChIKey
VOTHOORLZYRRGN-UHFFFAOYSA-N
Compound name
tert-butyl 3-(5-aminopyrazol-1-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.1743 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.18158 163.0
[M+Na]+ 289.16352 171.2
[M+NH4]+ 284.20812 168.3
[M+K]+ 305.13746 169.6
[M-H]- 265.16702 163.1
[M+Na-2H]- 287.14897 166.4
[M]+ 266.17375 163.7
[M]- 266.17485 163.7
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.