CID 164164

124428-19-9

Structural Information

Molecular Formula
C22H17FN2O
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)CCOC3=NC=NC4=C3C=CC=C4F
InChI
InChI=1S/C22H17FN2O/c23-20-8-4-7-19-21(20)24-15-25-22(19)26-14-13-16-9-11-18(12-10-16)17-5-2-1-3-6-17/h1-12,15H,13-14H2
InChIKey
JYAPXXSIEYEUPM-UHFFFAOYSA-N
Compound name
8-fluoro-4-[2-(4-phenylphenyl)ethoxy]quinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

344.13248 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.139756 183.3
[M+Na]+ 367.121698 191.7
[M-H]- 343.125204 189.4
[M+NH4]+ 362.166303 194.0
[M+K]+ 383.095638 183.9
[M+H-H2O]+ 327.129740 170.3
[M+HCOO]- 389.130681 201.9
[M+CH3COO]- 403.146331 192.9
[M+Na-2H]- 365.107146 189.4
[M]+ 344.13193142 183.1
[M]- 344.13302858 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

patents stripe