CID 3044164

Acridine, 9,10-dihydro-10-(3,4-dihydro-2,2-dimethyl-2h-pyrrol-5-yl)-, monohydrochloride

Structural Information

Molecular Formula
C19H20N2
SMILES
CC1(CCC(=N1)N2C3=CC=CC=C3CC4=CC=CC=C42)C
InChI
InChI=1S/C19H20N2/c1-19(2)12-11-18(20-19)21-16-9-5-3-7-14(16)13-15-8-4-6-10-17(15)21/h3-10H,11-13H2,1-2H3
InChIKey
VIVMIXMWLUFMJE-UHFFFAOYSA-N
Compound name
10-(5,5-dimethyl-3,4-dihydropyrrol-2-yl)-9H-acridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.16266 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.169936 167.7
[M+Na]+ 299.151878 176.8
[M-H]- 275.155384 173.5
[M+NH4]+ 294.196483 187.0
[M+K]+ 315.125818 170.3
[M+H-H2O]+ 259.159920 158.0
[M+HCOO]- 321.160861 185.1
[M+CH3COO]- 335.176511 179.0
[M+Na-2H]- 297.137326 172.3
[M]+ 276.16211142 166.0
[M]- 276.16320858 166.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.