CID 84457

14458-75-4

Structural Information

Molecular Formula

C₁₈H₁₉N

SMILES

C1CCC2(CC1)C3=CC=CC=C3NC4=CC=CC=C24

InChI

InChI=1S/C18H19N/c1-6-12-18(13-7-1)14-8-2-4-10-16(14)19-17-11-5-3-9-15(17)18/h2-5,8-11,19H,1,6-7,12-13H2

InChIKey

JKUQXMBYLVLQLN-UHFFFAOYSA-N

Compound name

spiro[10H-acridine-9,1'-cyclohexane]

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 249.15175 Da
Monoisotopic Mass: 5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	250.159026	158.4
[M+Na]+	272.140968	164.2
[M-H]-	248.144474	161.9
[M+NH4]+	267.185573	177.2
[M+K]+	288.114908	157.3
[M+H-H2O]+	232.149010	149.0
[M+HCOO]-	294.149951	172.3
[M+CH3COO]-	308.165601	168.3
[M+Na-2H]-	270.126416	166.3
[M]+	249.15120142	150.3
[M]-	249.15229858	150.3

Literature stripe

literature stripe

Patent stripe

patents stripe