CID 138989384

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

Structural Information

Molecular Formula
C7H8F2N2O
SMILES
C1C(CC1(F)F)C2=NOC(=C2)N
InChI
InChI=1S/C7H8F2N2O/c8-7(9)2-4(3-7)5-1-6(10)12-11-5/h1,4H,2-3,10H2
InChIKey
SLRCLGGSYMZHDQ-UHFFFAOYSA-N
Compound name
3-(3,3-difluorocyclobutyl)-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

174.06047 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.06775 129.1
[M+Na]+ 197.04969 137.3
[M-H]- 173.05319 132.8
[M+NH4]+ 192.09429 143.6
[M+K]+ 213.02363 139.1
[M+H-H2O]+ 157.05773 117.2
[M+HCOO]- 219.05867 149.5
[M+CH3COO]- 233.07432 182.9
[M+Na-2H]- 195.03514 134.3
[M]+ 174.05992 134.4
[M]- 174.06102 134.4
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