CID 616267

60547-97-9

Structural Information

Molecular Formula
C14H19N5O2
SMILES
COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCNCC3)N)OC
InChI
InChI=1S/C14H19N5O2/c1-20-11-7-9-10(8-12(11)21-2)17-14(18-13(9)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)
InChIKey
APKHJGDGWQDBGM-UHFFFAOYSA-N
Compound name
6,7-dimethoxy-2-piperazin-1-ylquinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

12
References

284
Patents

289.15387 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.161146 170.5
[M+Na]+ 312.143088 177.7
[M-H]- 288.146594 170.6
[M+NH4]+ 307.187693 180.3
[M+K]+ 328.117028 172.5
[M+H-H2O]+ 272.151130 159.8
[M+HCOO]- 334.152071 184.0
[M+CH3COO]- 348.167721 179.0
[M+Na-2H]- 310.128536 174.8
[M]+ 289.15332142 167.0
[M]- 289.15441858 167.0
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