CID 95566122

1312760-32-9

Structural Information

Molecular Formula
C12H20N4O3
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C2=NN=C(O2)N
InChI
InChI=1S/C12H20N4O3/c1-12(2,3)19-11(17)16-6-4-8(5-7-16)9-14-15-10(13)18-9/h8H,4-7H2,1-3H3,(H2,13,15)
InChIKey
SRUYAZKBNFXZHK-UHFFFAOYSA-N
Compound name
tert-butyl 4-(5-amino-1,3,4-oxadiazol-2-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

268.15353 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.16081 164.0
[M+Na]+ 291.14275 169.8
[M-H]- 267.14625 166.8
[M+NH4]+ 286.18735 176.3
[M+K]+ 307.11669 169.3
[M+H-H2O]+ 251.15079 155.5
[M+HCOO]- 313.15173 179.3
[M+CH3COO]- 327.16738 196.6
[M+Na-2H]- 289.12820 166.0
[M]+ 268.15298 162.3
[M]- 268.15408 162.3
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