CID 99600

71412-21-0

Structural Information

Molecular Formula
C20H24N2
SMILES
CC(C)C1=CC=C(C=C1)N2CC3=C(C=CC(=C3)C(C)C)N=C2
InChI
InChI=1S/C20H24N2/c1-14(2)16-5-8-19(9-6-16)22-12-18-11-17(15(3)4)7-10-20(18)21-13-22/h5-11,13-15H,12H2,1-4H3
InChIKey
HPYGVQVYBLTAJP-UHFFFAOYSA-N
Compound name
6-propan-2-yl-3-(4-propan-2-ylphenyl)-4H-quinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

0
Patents

292.19394 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.201216 173.0
[M+Na]+ 315.183158 179.5
[M-H]- 291.186664 177.3
[M+NH4]+ 310.227763 186.7
[M+K]+ 331.157098 174.1
[M+H-H2O]+ 275.191200 163.2
[M+HCOO]- 337.192141 188.8
[M+CH3COO]- 351.207791 183.0
[M+Na-2H]- 313.168606 175.4
[M]+ 292.19339142 172.2
[M]- 292.19448858 172.2
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.