CID 4185686

N-[3-(dimethylamino)propyl]-2,2,3,3,4,4,5,5,5-nonafluoropentanamide

Structural Information

Molecular Formula
C10H13F9N2O
SMILES
CN(C)CCCNC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H13F9N2O/c1-21(2)5-3-4-20-6(22)7(11,12)8(13,14)9(15,16)10(17,18)19/h3-5H2,1-2H3,(H,20,22)
InChIKey
LSTORYFJUHQATM-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

348.0884 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.09568 168.0
[M+Na]+ 371.07762 174.3
[M-H]- 347.08112 158.4
[M+NH4]+ 366.12222 180.6
[M+K]+ 387.05156 172.9
[M+H-H2O]+ 331.08566 155.8
[M+HCOO]- 393.08660 176.5
[M+CH3COO]- 407.10225 220.0
[M+Na-2H]- 369.06307 169.8
[M]+ 348.08785 155.7
[M]- 348.08895 155.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.