CID 16228811

2-phenyl-5,6,7,8-tetrahydroquinazolin-6-amine

Structural Information

Molecular Formula
C14H15N3
SMILES
C1CC2=NC(=NC=C2CC1N)C3=CC=CC=C3
InChI
InChI=1S/C14H15N3/c15-12-6-7-13-11(8-12)9-16-14(17-13)10-4-2-1-3-5-10/h1-5,9,12H,6-8,15H2
InChIKey
DBOFAIZAMCFPNL-UHFFFAOYSA-N
Compound name
2-phenyl-5,6,7,8-tetrahydroquinazolin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.1266 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.13388 150.7
[M+Na]+ 248.11582 157.9
[M-H]- 224.11932 154.7
[M+NH4]+ 243.16042 166.4
[M+K]+ 264.08976 152.6
[M+H-H2O]+ 208.12386 141.4
[M+HCOO]- 270.12480 169.8
[M+CH3COO]- 284.14045 161.9
[M+Na-2H]- 246.10127 158.1
[M]+ 225.12605 145.8
[M]- 225.12715 145.8
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.