CID 4178998

Methyl 1,2,3,4-tetrahydroacridine-9-carboxylate

Structural Information

Molecular Formula
C15H15NO2
SMILES
COC(=O)C1=C2CCCCC2=NC3=CC=CC=C31
InChI
InChI=1S/C15H15NO2/c1-18-15(17)14-10-6-2-4-8-12(10)16-13-9-5-3-7-11(13)14/h2,4,6,8H,3,5,7,9H2,1H3
InChIKey
UIINMWIYQHIFQH-UHFFFAOYSA-N
Compound name
methyl 1,2,3,4-tetrahydroacridine-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

241.11028 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 153.6
[M+Na]+ 264.09950 167.9
[M+NH4]+ 259.14410 163.2
[M+K]+ 280.07344 160.1
[M-H]- 240.10300 156.8
[M+Na-2H]- 262.08495 159.9
[M]+ 241.10973 156.6
[M]- 241.11083 156.6
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.