CID 20303

Icr 311

Structural Information

Molecular Formula
C23H24ClN3
SMILES
CCN(CCNC1=C2C=CC3=CC=CC=C3C2=NC4=CC=CC=C41)CCCl
InChI
InChI=1S/C23H24ClN3/c1-2-27(15-13-24)16-14-25-22-19-9-5-6-10-21(19)26-23-18-8-4-3-7-17(18)11-12-20(22)23/h3-12H,2,13-16H2,1H3,(H,25,26)
InChIKey
XAGZFKCVVINFRL-UHFFFAOYSA-N
Compound name
N-benzo[c]acridin-7-yl-N'-(2-chloroethyl)-N'-ethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.16586 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.17314 189.5
[M+Na]+ 400.15508 197.6
[M-H]- 376.15858 194.6
[M+NH4]+ 395.19968 204.0
[M+K]+ 416.12902 189.7
[M+H-H2O]+ 360.16312 179.6
[M+HCOO]- 422.16406 206.3
[M+CH3COO]- 436.17971 199.2
[M+Na-2H]- 398.14053 198.0
[M]+ 377.16531 195.4
[M]- 377.16641 195.4
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.