CID 22014528

39512-63-5

Structural Information

Molecular Formula
C7H11N3O3
SMILES
CC(C)(C)OC(=O)NC1=NOC=N1
InChI
InChI=1S/C7H11N3O3/c1-7(2,3)13-6(11)9-5-8-4-12-10-5/h4H,1-3H3,(H,9,10,11)
InChIKey
REWQNYFPXZTNHQ-UHFFFAOYSA-N
Compound name
tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

185.08005 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.087326 138.8
[M+Na]+ 208.069268 146.6
[M-H]- 184.072774 140.8
[M+NH4]+ 203.113873 156.2
[M+K]+ 224.043208 147.9
[M+H-H2O]+ 168.077310 132.0
[M+HCOO]- 230.078251 160.6
[M+CH3COO]- 244.093901 179.9
[M+Na-2H]- 206.054716 146.5
[M]+ 185.07950142 141.7
[M]- 185.08059858 141.7
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

patents stripe