CID 2757337

2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

Structural Information

Molecular Formula
C18H21NO2
SMILES
CC(C)(C)C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)O
InChI
InChI=1S/C18H21NO2/c1-18(2,3)11-8-9-15-13(10-11)16(17(20)21)12-6-4-5-7-14(12)19-15/h4-7,11H,8-10H2,1-3H3,(H,20,21)
InChIKey
OLFUQJZKMJBHMQ-UHFFFAOYSA-N
Compound name
2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

283.15723 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.16451 167.0
[M+Na]+ 306.14645 180.1
[M+NH4]+ 301.19105 175.5
[M+K]+ 322.12039 173.4
[M-H]- 282.14995 169.0
[M+Na-2H]- 304.13190 171.7
[M]+ 283.15668 169.5
[M]- 283.15778 169.5
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.