CID 13707820

4-chloro-5,6,7,8-tetrahydroquinazolin-2-amine

Structural Information

Molecular Formula
C8H10ClN3
SMILES
C1CCC2=C(C1)C(=NC(=N2)N)Cl
InChI
InChI=1S/C8H10ClN3/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H2,(H2,10,11,12)
InChIKey
BTLNLOHFQGIGLV-UHFFFAOYSA-N
Compound name
4-chloro-5,6,7,8-tetrahydroquinazolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

183.05632 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.06360 135.0
[M+Na]+ 206.04554 148.9
[M+NH4]+ 201.09014 144.6
[M+K]+ 222.01948 141.6
[M-H]- 182.04904 137.8
[M+Na-2H]- 204.03099 141.8
[M]+ 183.05577 138.0
[M]- 183.05687 138.0
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