CID 207925

4,4-dimethyl-2-(trifluoromethyl)-1,3-oxazolidine

Structural Information

Molecular Formula
C6H10F3NO
SMILES
CC1(COC(N1)C(F)(F)F)C
InChI
InChI=1S/C6H10F3NO/c1-5(2)3-11-4(10-5)6(7,8)9/h4,10H,3H2,1-2H3
InChIKey
AVEJFSNLMOFPTA-UHFFFAOYSA-N
Compound name
4,4-dimethyl-2-(trifluoromethyl)-1,3-oxazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.07144 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.078716 129.9
[M+Na]+ 192.060658 138.5
[M-H]- 168.064164 127.7
[M+NH4]+ 187.105263 151.0
[M+K]+ 208.034598 137.8
[M+H-H2O]+ 152.068700 123.5
[M+HCOO]- 214.069641 145.0
[M+CH3COO]- 228.085291 173.7
[M+Na-2H]- 190.046106 135.5
[M]+ 169.07089142 123.7
[M]- 169.07198858 123.7
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.