CID 64754707

6-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine

Structural Information

Molecular Formula
C9H10F3N3
SMILES
C1CC2=NC(=NC=C2CC1C(F)(F)F)N
InChI
InChI=1S/C9H10F3N3/c10-9(11,12)6-1-2-7-5(3-6)4-14-8(13)15-7/h4,6H,1-3H2,(H2,13,14,15)
InChIKey
URBPOTZHKLPAEG-UHFFFAOYSA-N
Compound name
6-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.08269 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.08997 144.4
[M+Na]+ 240.07191 153.1
[M+NH4]+ 235.11651 150.2
[M+K]+ 256.04585 148.3
[M-H]- 216.07541 141.6
[M+Na-2H]- 238.05736 148.0
[M]+ 217.08214 144.5
[M]- 217.08324 144.5
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.