CID 164166

124428-38-2

Structural Information

Molecular Formula
C18H17FN2O3
SMILES
COC1=C(C=C(C=C1)CCOC2=NC=NC3=C2C=CC=C3F)OC
InChI
InChI=1S/C18H17FN2O3/c1-22-15-7-6-12(10-16(15)23-2)8-9-24-18-13-4-3-5-14(19)17(13)20-11-21-18/h3-7,10-11H,8-9H2,1-2H3
InChIKey
YIUHSNOGUCWWJD-UHFFFAOYSA-N
Compound name
4-[2-(3,4-dimethoxyphenyl)ethoxy]-8-fluoroquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

328.1223 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.12958 177.5
[M+Na]+ 351.11152 193.1
[M+NH4]+ 346.15612 184.5
[M+K]+ 367.08546 184.7
[M-H]- 327.11502 180.1
[M+Na-2H]- 349.09697 185.4
[M]+ 328.12175 180.6
[M]- 328.12285 180.6
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