CID 218595

40889-54-1

Structural Information

Molecular Formula
C11H10Br2N4O2
SMILES
CC1=NC2=C(C=C(C=C2Br)Br)C(=O)N1CC(=O)NN
InChI
InChI=1S/C11H10Br2N4O2/c1-5-15-10-7(2-6(12)3-8(10)13)11(19)17(5)4-9(18)16-14/h2-3H,4,14H2,1H3,(H,16,18)
InChIKey
LODWVYBYTOJAJU-UHFFFAOYSA-N
Compound name
2-(6,8-dibromo-2-methyl-4-oxoquinazolin-3-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

387.91705 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.92433 153.8
[M+Na]+ 410.90627 164.7
[M-H]- 386.90977 159.0
[M+NH4]+ 405.95087 168.2
[M+K]+ 426.88021 148.1
[M+H-H2O]+ 370.91431 159.1
[M+HCOO]- 432.91525 168.1
[M+CH3COO]- 446.93090 220.3
[M+Na-2H]- 408.89172 159.9
[M]+ 387.91650 187.7
[M]- 387.91760 187.7
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

No patent data available for this compound.