CID 164161

N-(2-(2-naphthalenyl)ethyl)-4-quinazolinamine

Structural Information

Molecular Formula
C20H17N3
SMILES
C1=CC=C2C=C(C=CC2=C1)CCNC3=NC=NC4=CC=CC=C43
InChI
InChI=1S/C20H17N3/c1-2-6-17-13-15(9-10-16(17)5-1)11-12-21-20-18-7-3-4-8-19(18)22-14-23-20/h1-10,13-14H,11-12H2,(H,21,22,23)
InChIKey
FSLSBRBLTSYCQH-UHFFFAOYSA-N
Compound name
N-(2-naphthalen-2-ylethyl)quinazolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

299.14224 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.14952 169.2
[M+Na]+ 322.13146 177.9
[M-H]- 298.13496 174.7
[M+NH4]+ 317.17606 182.9
[M+K]+ 338.10540 170.2
[M+H-H2O]+ 282.13950 158.3
[M+HCOO]- 344.14044 190.5
[M+CH3COO]- 358.15609 180.0
[M+Na-2H]- 320.11691 180.4
[M]+ 299.14169 169.9
[M]- 299.14279 169.9
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