CID 119030885

2-[5-(trifluoromethyl)-1,2-oxazol-3-yl]propan-2-amine hydrochloride

Structural Information

Molecular Formula
C7H9F3N2O
SMILES
CC(C)(C1=NOC(=C1)C(F)(F)F)N
InChI
InChI=1S/C7H9F3N2O/c1-6(2,11)4-3-5(13-12-4)7(8,9)10/h3H,11H2,1-2H3
InChIKey
IRSKYGXXIMIDOP-UHFFFAOYSA-N
Compound name
2-[5-(trifluoromethyl)-1,2-oxazol-3-yl]propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.0667 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.07398 136.1
[M+Na]+ 217.05592 145.3
[M-H]- 193.05942 135.3
[M+NH4]+ 212.10052 154.5
[M+K]+ 233.02986 144.6
[M+H-H2O]+ 177.06396 128.4
[M+HCOO]- 239.06490 154.1
[M+CH3COO]- 253.08055 183.7
[M+Na-2H]- 215.04137 142.4
[M]+ 194.06615 132.3
[M]- 194.06725 132.3
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.