CID 12637186

2-(trifluoromethyl)-1,3-dioxolan-2-amine

Structural Information

Molecular Formula
C4H6F3NO2
SMILES
C1COC(O1)(C(F)(F)F)N
InChI
InChI=1S/C4H6F3NO2/c5-3(6,7)4(8)9-1-2-10-4/h1-2,8H2
InChIKey
BUBYVSFCHYNWMD-UHFFFAOYSA-N
Compound name
2-(trifluoromethyl)-1,3-dioxolan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.03506 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.042336 123.7
[M+Na]+ 180.024278 131.7
[M-H]- 156.027784 124.3
[M+NH4]+ 175.068883 144.9
[M+K]+ 195.998218 133.3
[M+H-H2O]+ 140.032320 117.7
[M+HCOO]- 202.033261 141.9
[M+CH3COO]- 216.048911 172.8
[M+Na-2H]- 178.009726 132.0
[M]+ 157.03451142 118.0
[M]- 157.03560858 118.0
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.