CID 2758484

6,7-dimethoxy-4-piperazin-1-yl-quinazoline

Structural Information

Molecular Formula
C14H18N4O2
SMILES
COC1=C(C=C2C(=C1)C(=NC=N2)N3CCNCC3)OC
InChI
InChI=1S/C14H18N4O2/c1-19-12-7-10-11(8-13(12)20-2)16-9-17-14(10)18-5-3-15-4-6-18/h7-9,15H,3-6H2,1-2H3
InChIKey
HGQPTOFRZXUHHS-UHFFFAOYSA-N
Compound name
6,7-dimethoxy-4-piperazin-1-ylquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

70
Patents

274.14297 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.15025 166.3
[M+Na]+ 297.13219 173.3
[M-H]- 273.13569 166.4
[M+NH4]+ 292.17679 176.9
[M+K]+ 313.10613 168.4
[M+H-H2O]+ 257.14023 155.3
[M+HCOO]- 319.14117 179.3
[M+CH3COO]- 333.15682 175.2
[M+Na-2H]- 295.11764 171.6
[M]+ 274.14242 163.8
[M]- 274.14352 163.8
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