CID 43958

Fluomine dust

Structural Information

Molecular Formula
C16H14F2N2O2
SMILES
C1=CC(=C(C(=C1)F)C=NCCN=CC2=C(C=CC=C2F)O)O
InChI
InChI=1S/C16H14F2N2O2/c17-13-3-1-5-15(21)11(13)9-19-7-8-20-10-12-14(18)4-2-6-16(12)22/h1-6,9-10,21-22H,7-8H2
InChIKey
SDZOMCAJWGPLAU-UHFFFAOYSA-N
Compound name
3-fluoro-2-[2-[(2-fluoro-6-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

2
References

0
Patents

304.10233 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.10961 169.8
[M+Na]+ 327.09155 181.0
[M+NH4]+ 322.13615 175.4
[M+K]+ 343.06549 173.4
[M-H]- 303.09505 171.5
[M+Na-2H]- 325.07700 176.2
[M]+ 304.10178 171.5
[M]- 304.10288 171.5
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

No patent data available for this compound.