CID 162485557

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

Structural Information

Molecular Formula
C9H14N2O
SMILES
CC1(CC(C1)C2=NOC(=C2)N)C
InChI
InChI=1S/C9H14N2O/c1-9(2)4-6(5-9)7-3-8(10)12-11-7/h3,6H,4-5,10H2,1-2H3
InChIKey
FPVJIZIHNFOULB-UHFFFAOYSA-N
Compound name
3-(3,3-dimethylcyclobutyl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

166.11061 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.11789 132.6
[M+Na]+ 189.09983 139.9
[M-H]- 165.10333 138.8
[M+NH4]+ 184.14443 147.7
[M+K]+ 205.07377 142.1
[M+H-H2O]+ 149.10787 122.3
[M+HCOO]- 211.10881 154.5
[M+CH3COO]- 225.12446 183.4
[M+Na-2H]- 187.08528 138.0
[M]+ 166.11006 140.9
[M]- 166.11116 140.9
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