CID 97231

80039-84-5

Structural Information

Molecular Formula
C20H27N3O
SMILES
CCN(CC)CCNC(=O)C1=C2CCCCC2=NC3=CC=CC=C31
InChI
InChI=1S/C20H27N3O/c1-3-23(4-2)14-13-21-20(24)19-15-9-5-7-11-17(15)22-18-12-8-6-10-16(18)19/h5,7,9,11H,3-4,6,8,10,12-14H2,1-2H3,(H,21,24)
InChIKey
OEDBPEVMRIBDOP-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]-1,2,3,4-tetrahydroacridine-9-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

325.21542 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.22270 178.9
[M+Na]+ 348.20464 182.3
[M-H]- 324.20814 182.5
[M+NH4]+ 343.24924 193.4
[M+K]+ 364.17858 178.3
[M+H-H2O]+ 308.21268 169.4
[M+HCOO]- 370.21362 196.9
[M+CH3COO]- 384.22927 219.7
[M+Na-2H]- 346.19009 183.2
[M]+ 325.21487 178.2
[M]- 325.21597 178.2
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.