CID 2788657

256411-48-0

Structural Information

Molecular Formula
C10H8F3NO3
SMILES
C1COC2=C(O1)C=CC(=C2)NC(=O)C(F)(F)F
InChI
InChI=1S/C10H8F3NO3/c11-10(12,13)9(15)14-6-1-2-7-8(5-6)17-4-3-16-7/h1-2,5H,3-4H2,(H,14,15)
InChIKey
QDOWSCHKYQBJPM-UHFFFAOYSA-N
Compound name
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2,2-trifluoroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.04562 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.05290 154.5
[M+Na]+ 270.03484 162.6
[M+NH4]+ 265.07944 159.6
[M+K]+ 286.00878 158.8
[M-H]- 246.03834 153.8
[M+Na-2H]- 268.02029 156.4
[M]+ 247.04507 155.1
[M]- 247.04617 155.1
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.