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]+ 158.04234 123.7
[M+Na]+ 180.02428 131.7
[M-H]- 156.02778 124.3
[M+NH4]+ 175.06888 144.9
[M+K]+ 195.99822 133.3
[M+H-H2O]+ 140.03232 117.7
[M+HCOO]- 202.03326 141.9
[M+CH3COO]- 216.04891 172.8
[M+Na-2H]- 178.00973 132.0
[M]+ 157.03451 118.0
[M]- 157.03561 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.