CID 3670148

618443-76-8

Structural Information

Molecular Formula
C18H15Cl2N3O3
SMILES
CCOC1=CC=CC=C1NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3Cl)Cl
InChI
InChI=1S/C18H15Cl2N3O3/c1-2-26-15-6-4-3-5-14(15)22-16(24)9-23-10-21-17-12(18(23)25)7-11(19)8-13(17)20/h3-8,10H,2,9H2,1H3,(H,22,24)
InChIKey
QFAPLISSBLCFPU-UHFFFAOYSA-N
Compound name
2-(6,8-dichloro-4-oxoquinazolin-3-yl)-N-(2-ethoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

391.04904 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.05632 185.6
[M+Na]+ 414.03826 196.4
[M-H]- 390.04176 190.3
[M+NH4]+ 409.08286 196.7
[M+K]+ 430.01220 189.5
[M+H-H2O]+ 374.04630 176.7
[M+HCOO]- 436.04724 196.8
[M+CH3COO]- 450.06289 220.5
[M+Na-2H]- 412.02371 189.4
[M]+ 391.04849 192.7
[M]- 391.04959 192.7
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.