CID 63684

4(1h)-quinazolinone, 2-chloro-6,7-dimethoxy-, (1-methylethylidene)hydrazone, monohydrochloride

Structural Information

Molecular Formula
C13H15ClN4O2
SMILES
CC(=NNC1=NC(=NC2=CC(=C(C=C21)OC)OC)Cl)C
InChI
InChI=1S/C13H15ClN4O2/c1-7(2)17-18-12-8-5-10(19-3)11(20-4)6-9(8)15-13(14)16-12/h5-6H,1-4H3,(H,15,16,18)
InChIKey
DQXRWRWPNKZYJQ-UHFFFAOYSA-N
Compound name
2-chloro-6,7-dimethoxy-N-(propan-2-ylideneamino)quinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.08835 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.09563 165.5
[M+Na]+ 317.07757 175.6
[M-H]- 293.08107 169.2
[M+NH4]+ 312.12217 180.9
[M+K]+ 333.05151 171.8
[M+H-H2O]+ 277.08561 157.5
[M+HCOO]- 339.08655 184.4
[M+CH3COO]- 353.10220 210.5
[M+Na-2H]- 315.06302 171.6
[M]+ 294.08780 172.1
[M]- 294.08890 172.1
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.