CID 720254

4-(((4-fluorophenyl)imino)methyl)phenol

Structural Information

Molecular Formula
C13H10FNO
SMILES
C1=CC(=CC=C1C=NC2=CC=C(C=C2)F)O
InChI
InChI=1S/C13H10FNO/c14-11-3-5-12(6-4-11)15-9-10-1-7-13(16)8-2-10/h1-9,16H
InChIKey
VNNJGDYPPLXJFF-UHFFFAOYSA-N
Compound name
4-[(4-fluorophenyl)iminomethyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

215.07465 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.08193 144.0
[M+Na]+ 238.06387 152.5
[M-H]- 214.06737 149.8
[M+NH4]+ 233.10847 162.4
[M+K]+ 254.03781 148.2
[M+H-H2O]+ 198.07191 135.9
[M+HCOO]- 260.07285 169.2
[M+CH3COO]- 274.08850 189.3
[M+Na-2H]- 236.04932 151.0
[M]+ 215.07410 142.4
[M]- 215.07520 142.4
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

patents stripe