CID 24938303

1-(2-amino-1-naphthyl)isoquinoline

Structural Information

Molecular Formula
C19H14N2
SMILES
C1=CC=C2C(=C1)C=CC(=C2C3=NC=CC4=CC=CC=C43)N
InChI
InChI=1S/C19H14N2/c20-17-10-9-13-5-1-3-7-15(13)18(17)19-16-8-4-2-6-14(16)11-12-21-19/h1-12H,20H2
InChIKey
OYLNFFGFQUEPML-UHFFFAOYSA-N
Compound name
1-isoquinolin-1-ylnaphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

270.1157 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.12298 161.4
[M+Na]+ 293.10492 171.6
[M-H]- 269.10842 168.6
[M+NH4]+ 288.14952 177.8
[M+K]+ 309.07886 164.2
[M+H-H2O]+ 253.11296 152.0
[M+HCOO]- 315.11390 183.9
[M+CH3COO]- 329.12955 173.6
[M+Na-2H]- 291.09037 171.3
[M]+ 270.11515 160.9
[M]- 270.11625 160.9
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

patents stripe