CID 614894

N-dodecyl-2,2,3,3,4,4,4-heptafluorobutanamide

Structural Information

Molecular Formula
C16H26F7NO
SMILES
CCCCCCCCCCCCNC(=O)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C16H26F7NO/c1-2-3-4-5-6-7-8-9-10-11-12-24-13(25)14(17,18)15(19,20)16(21,22)23/h2-12H2,1H3,(H,24,25)
InChIKey
UTGSQSVMPFAJMN-UHFFFAOYSA-N
Compound name
N-dodecyl-2,2,3,3,4,4,4-heptafluorobutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

381.19025 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.19753 197.2
[M+Na]+ 404.17947 197.6
[M+NH4]+ 399.22407 196.6
[M+K]+ 420.15341 193.6
[M-H]- 380.18297 188.1
[M+Na-2H]- 402.16492 193.2
[M]+ 381.18970 194.1
[M]- 381.19080 194.1
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.