CID 86152519

2,2,3,3,4,4,4-heptafluoro-n'-[(pyridin-4-yl)methylidene]butanehydrazide

Structural Information

Molecular Formula
C10H6F7N3O
SMILES
C1=CN=CC=C1C=NNC(=O)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10H6F7N3O/c11-8(12,9(13,14)10(15,16)17)7(21)20-19-5-6-1-3-18-4-2-6/h1-5H,(H,20,21)
InChIKey
YFAWEJJVFJXUJF-UHFFFAOYSA-N
Compound name
2,2,3,3,4,4,4-heptafluoro-N-(pyridin-4-ylmethylideneamino)butanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

317.03992 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.04720 160.6
[M+Na]+ 340.02914 168.3
[M-H]- 316.03264 155.3
[M+NH4]+ 335.07374 173.2
[M+K]+ 356.00308 164.9
[M+H-H2O]+ 300.03718 147.8
[M+HCOO]- 362.03812 174.2
[M+CH3COO]- 376.05377 209.3
[M+Na-2H]- 338.01459 166.5
[M]+ 317.03937 150.3
[M]- 317.04047 150.3
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.