CID 135409305

179688-29-0

Structural Information

Molecular Formula
C14H18N2O5
SMILES
COCCOC1=C(C=C2C(=C1)C(=O)NC=N2)OCCOC
InChI
InChI=1S/C14H18N2O5/c1-18-3-5-20-12-7-10-11(15-9-16-14(10)17)8-13(12)21-6-4-19-2/h7-9H,3-6H2,1-2H3,(H,15,16,17)
InChIKey
PMQWTUWLIGJTQD-UHFFFAOYSA-N
Compound name
6,7-bis(2-methoxyethoxy)-3H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

153
Patents

294.12158 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.12886 166.3
[M+Na]+ 317.11080 178.9
[M+NH4]+ 312.15540 171.7
[M+K]+ 333.08474 173.1
[M-H]- 293.11430 165.9
[M+Na-2H]- 315.09625 170.5
[M]+ 294.12103 167.7
[M]- 294.12213 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

literature stripe

Patent stripe

patents stripe