CID 4073367

N-[4-(heptafluoropropyl)phenyl]acetamide

Structural Information

Molecular Formula
C11H8F7NO
SMILES
CC(=O)NC1=CC=C(C=C1)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H8F7NO/c1-6(20)19-8-4-2-7(3-5-8)9(12,13)10(14,15)11(16,17)18/h2-5H,1H3,(H,19,20)
InChIKey
DGTLBPOBSFXXAK-UHFFFAOYSA-N
Compound name
N-[4-(1,1,2,2,3,3,3-heptafluoropropyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

303.0494 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.05668 177.7
[M+Na]+ 326.03862 180.4
[M+NH4]+ 321.08322 178.3
[M+K]+ 342.01256 177.3
[M-H]- 302.04212 170.3
[M+Na-2H]- 324.02407 177.0
[M]+ 303.04885 175.5
[M]- 303.04995 175.5
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

patents stripe