CID 719699

2-phenyl-4-(1-pyrrolidinyl)quinazoline

Structural Information

Molecular Formula
C18H17N3
SMILES
C1CCN(C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4
InChI
InChI=1S/C18H17N3/c1-2-8-14(9-3-1)17-19-16-11-5-4-10-15(16)18(20-17)21-12-6-7-13-21/h1-5,8-11H,6-7,12-13H2
InChIKey
YUMGURVFGSPTRR-UHFFFAOYSA-N
Compound name
2-phenyl-4-pyrrolidin-1-ylquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

275.14224 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.14952 165.8
[M+Na]+ 298.13146 182.1
[M+NH4]+ 293.17606 175.3
[M+K]+ 314.10540 174.3
[M-H]- 274.13496 172.0
[M+Na-2H]- 296.11691 176.4
[M]+ 275.14169 170.0
[M]- 275.14279 170.0
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