CID 330442

6-chloro-4-hydrazinoquinazoline

Structural Information

Molecular Formula
C8H7ClN4
SMILES
C1=CC2=C(C=C1Cl)C(=NC=N2)NN
InChI
InChI=1S/C8H7ClN4/c9-5-1-2-7-6(3-5)8(13-10)12-4-11-7/h1-4H,10H2,(H,11,12,13)
InChIKey
JVMVBNLPTAQWNP-UHFFFAOYSA-N
Compound name
(6-chloroquinazolin-4-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

194.03592 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04320 136.8
[M+Na]+ 217.02514 147.2
[M-H]- 193.02864 138.6
[M+NH4]+ 212.06974 155.0
[M+K]+ 232.99908 142.1
[M+H-H2O]+ 177.03318 129.9
[M+HCOO]- 239.03412 155.9
[M+CH3COO]- 253.04977 149.8
[M+Na-2H]- 215.01059 146.9
[M]+ 194.03537 136.7
[M]- 194.03647 136.7
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