CID 145913011

1874211-56-9

Structural Information

Molecular Formula
C11H20N6O2
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)(C2=NNN=N2)N
InChI
InChI=1S/C11H20N6O2/c1-10(2,3)19-9(18)17-6-4-11(12,5-7-17)8-13-15-16-14-8/h4-7,12H2,1-3H3,(H,13,14,15,16)
InChIKey
PTILCGQGAZWXST-UHFFFAOYSA-N
Compound name
tert-butyl 4-amino-4-(2H-tetrazol-5-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.16476 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.17204 164.7
[M+Na]+ 291.15398 170.5
[M-H]- 267.15748 163.0
[M+NH4]+ 286.19858 176.6
[M+K]+ 307.12792 168.1
[M+H-H2O]+ 251.16202 155.6
[M+HCOO]- 313.16296 176.9
[M+CH3COO]- 327.17861 193.3
[M+Na-2H]- 289.13943 168.0
[M]+ 268.16421 159.8
[M]- 268.16531 159.8
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.