CID 59394716

5-(2,2-dimethylpropyl)-1,2-oxazol-3-amine

Structural Information

Molecular Formula
C8H14N2O
SMILES
CC(C)(C)CC1=CC(=NO1)N
InChI
InChI=1S/C8H14N2O/c1-8(2,3)5-6-4-7(9)10-11-6/h4H,5H2,1-3H3,(H2,9,10)
InChIKey
VMGAMLNPHPPPQF-UHFFFAOYSA-N
Compound name
5-(2,2-dimethylpropyl)-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

154.11061 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.117886 133.8
[M+Na]+ 177.099828 142.2
[M-H]- 153.103334 136.7
[M+NH4]+ 172.144433 154.1
[M+K]+ 193.073768 142.1
[M+H-H2O]+ 137.107870 128.2
[M+HCOO]- 199.108811 156.3
[M+CH3COO]- 213.124461 177.9
[M+Na-2H]- 175.085276 140.4
[M]+ 154.11006142 134.6
[M]- 154.11115858 134.6
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