CID 4178998

55618-86-5

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 152.9
[M+Na]+ 264.09950 160.2
[M-H]- 240.10300 156.4
[M+NH4]+ 259.14410 171.0
[M+K]+ 280.07344 156.5
[M+H-H2O]+ 224.10754 145.1
[M+HCOO]- 286.10848 170.5
[M+CH3COO]- 300.12413 164.6
[M+Na-2H]- 262.08495 159.7
[M]+ 241.10973 152.1
[M]- 241.11083 152.1
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.