CID 3080425

Brn 4332771

Structural Information

Molecular Formula
C17H15BrF2N2O3
SMILES
CC(C(=O)NNC(=O)C(C1=CC=C(C=C1)F)(C2=CC=C(C=C2)F)O)Br
InChI
InChI=1S/C17H15BrF2N2O3/c1-10(18)15(23)21-22-16(24)17(25,11-2-6-13(19)7-3-11)12-4-8-14(20)9-5-12/h2-10,25H,1H3,(H,21,23)(H,22,24)
InChIKey
JHAGHEGHBXWLAE-UHFFFAOYSA-N
Compound name
N'-[2,2-bis(4-fluorophenyl)-2-hydroxyacetyl]-2-bromopropanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.0234 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.03068 185.3
[M+Na]+ 435.01262 184.5
[M+NH4]+ 430.05722 186.1
[M+K]+ 450.98656 186.1
[M-H]- 411.01612 183.4
[M+Na-2H]- 432.99807 186.5
[M]+ 412.02285 183.1
[M]- 412.02395 183.1
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.