CID 252551

Nsc74605

Structural Information

Molecular Formula
C23H19ClN2O
SMILES
COC1=CC2=C(C=C1)N(CCC2)C3=C4C=CC(=CC4=NC5=CC=CC=C53)Cl
InChI
InChI=1S/C23H19ClN2O/c1-27-17-9-11-22-15(13-17)5-4-12-26(22)23-18-6-2-3-7-20(18)25-21-14-16(24)8-10-19(21)23/h2-3,6-11,13-14H,4-5,12H2,1H3
InChIKey
JFNIZJXSGPCLGN-UHFFFAOYSA-N
Compound name
3-chloro-9-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)acridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.1186 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.12588 189.5
[M+Na]+ 397.10782 199.9
[M-H]- 373.11132 195.5
[M+NH4]+ 392.15242 202.4
[M+K]+ 413.08176 191.1
[M+H-H2O]+ 357.11586 177.7
[M+HCOO]- 419.11680 200.7
[M+CH3COO]- 433.13245 199.0
[M+Na-2H]- 395.09327 195.9
[M]+ 374.11805 192.3
[M]- 374.11915 192.3
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.