CID 390091

Nsc687034

Structural Information

Molecular Formula
C10H19N3O2
SMILES
CC(C)(C)NC1=NOC(=O)N1C(C)(C)C
InChI
InChI=1S/C10H19N3O2/c1-9(2,3)11-7-12-15-8(14)13(7)10(4,5)6/h1-6H3,(H,11,12)
InChIKey
POYOOYIPXBXFSD-UHFFFAOYSA-N
Compound name
4-tert-butyl-3-(tert-butylamino)-1,2,4-oxadiazol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.14772 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.15500 149.6
[M+Na]+ 236.13694 158.7
[M-H]- 212.14044 152.1
[M+NH4]+ 231.18154 166.8
[M+K]+ 252.11088 158.7
[M+H-H2O]+ 196.14498 143.7
[M+HCOO]- 258.14592 169.5
[M+CH3COO]- 272.16157 189.7
[M+Na-2H]- 234.12239 156.4
[M]+ 213.14717 153.1
[M]- 213.14827 153.1
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.