CID 2771941

2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

Structural Information

Molecular Formula
C15H15NO2
SMILES
CC1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O
InChI
InChI=1S/C15H15NO2/c1-9-6-7-13-11(8-9)14(15(17)18)10-4-2-3-5-12(10)16-13/h2-5,9H,6-8H2,1H3,(H,17,18)
InChIKey
ZKCKKMVBVAVEIY-UHFFFAOYSA-N
Compound name
2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
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 153.0
[M+Na]+ 264.09950 160.8
[M-H]- 240.10300 155.5
[M+NH4]+ 259.14410 170.7
[M+K]+ 280.07344 156.3
[M+H-H2O]+ 224.10754 145.8
[M+HCOO]- 286.10848 169.0
[M+CH3COO]- 300.12413 164.4
[M+Na-2H]- 262.08495 158.7
[M]+ 241.10973 151.0
[M]- 241.11083 151.0
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.