CID 3071106

Brn 5073092

Structural Information

Molecular Formula
C14H18ClN3O2
SMILES
CCN1C2=C(C=CC(=C2)Cl)C(=O)N(C1=O)N(CC)CC
InChI
InChI=1S/C14H18ClN3O2/c1-4-16(5-2)18-13(19)11-8-7-10(15)9-12(11)17(6-3)14(18)20/h7-9H,4-6H2,1-3H3
InChIKey
PSXZJTRBSNJARC-UHFFFAOYSA-N
Compound name
7-chloro-3-(diethylamino)-1-ethylquinazoline-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.10876 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.11604 164.7
[M+Na]+ 318.09798 179.9
[M+NH4]+ 313.14258 172.0
[M+K]+ 334.07192 172.4
[M-H]- 294.10148 166.8
[M+Na-2H]- 316.08343 170.4
[M]+ 295.10821 167.7
[M]- 295.10931 167.7
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.