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

8
Patents

174.06047 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.067746 129.1
[M+Na]+ 197.049688 137.3
[M-H]- 173.053194 132.8
[M+NH4]+ 192.094293 143.6
[M+K]+ 213.023628 139.1
[M+H-H2O]+ 157.057730 117.2
[M+HCOO]- 219.058671 149.5
[M+CH3COO]- 233.074321 182.9
[M+Na-2H]- 195.035136 134.3
[M]+ 174.05992142 134.4
[M]- 174.06101858 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