CID 207922

2-(trifluoromethyl)-1,3-oxazolidine

Structural Information

Molecular Formula
C4H6F3NO
SMILES
C1COC(N1)C(F)(F)F
InChI
InChI=1S/C4H6F3NO/c5-4(6,7)3-8-1-2-9-3/h3,8H,1-2H2
InChIKey
FBPSIMNHRRIBKV-UHFFFAOYSA-N
Compound name
2-(trifluoromethyl)-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

25
Patents

141.04015 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.04743 132.6
[M+Na]+ 164.02937 139.2
[M+NH4]+ 159.07397 138.0
[M+K]+ 180.00331 137.3
[M-H]- 140.03287 128.9
[M+Na-2H]- 162.01482 134.0
[M]+ 141.03960 132.0
[M]- 141.04070 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe