CID 164157

N-(2-(3-pheoxyphenyl)ethyl)-4-quinazolinamine

Structural Information

Molecular Formula
C22H19N3O
SMILES
C1=CC=C(C=C1)OC2=CC=CC(=C2)CCNC3=NC=NC4=CC=CC=C43
InChI
InChI=1S/C22H19N3O/c1-2-8-18(9-3-1)26-19-10-6-7-17(15-19)13-14-23-22-20-11-4-5-12-21(20)24-16-25-22/h1-12,15-16H,13-14H2,(H,23,24,25)
InChIKey
CMVUZTOUJSFFNK-UHFFFAOYSA-N
Compound name
N-[2-(3-phenoxyphenyl)ethyl]quinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

341.1528 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.16008 181.1
[M+Na]+ 364.14202 187.6
[M-H]- 340.14552 188.2
[M+NH4]+ 359.18662 191.3
[M+K]+ 380.11596 180.3
[M+H-H2O]+ 324.15006 168.9
[M+HCOO]- 386.15100 201.9
[M+CH3COO]- 400.16665 190.6
[M+Na-2H]- 362.12747 189.7
[M]+ 341.15225 181.0
[M]- 341.15335 181.0
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