CID 344180

6-chloro-4-ethoxyquinazoline

Structural Information

Molecular Formula
C10H9ClN2O
SMILES
CCOC1=NC=NC2=C1C=C(C=C2)Cl
InChI
InChI=1S/C10H9ClN2O/c1-2-14-10-8-5-7(11)3-4-9(8)12-6-13-10/h3-6H,2H2,1H3
InChIKey
ZBDPLPRMJBHVSC-UHFFFAOYSA-N
Compound name
6-chloro-4-ethoxyquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.04034 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.047616 140.5
[M+Na]+ 231.029558 151.6
[M-H]- 207.033064 142.5
[M+NH4]+ 226.074163 159.1
[M+K]+ 247.003498 147.1
[M+H-H2O]+ 191.037600 133.5
[M+HCOO]- 253.038541 157.6
[M+CH3COO]- 267.054191 153.9
[M+Na-2H]- 229.015006 149.6
[M]+ 208.03979142 144.7
[M]- 208.04088858 144.7
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.