CID 13663242

7-chlorobenzo(c)acridine

Structural Information

Molecular Formula

C₁₇H₁₀ClN

SMILES

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)Cl

InChI

InChI=1S/C17H10ClN/c18-16-13-7-3-4-8-15(13)19-17-12-6-2-1-5-11(12)9-10-14(16)17/h1-10H

InChIKey

YNTMIEJJICGRRP-UHFFFAOYSA-N

Compound name

7-chlorobenzo[c]acridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 263.05017 Da
Monoisotopic Mass: 5.4
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]+	264.05745	155.2
[M+Na]+	286.03939	167.9
[M-H]-	262.04289	160.5
[M+NH4]+	281.08399	174.7
[M+K]+	302.01333	159.8
[M+H-H2O]+	246.04743	147.3
[M+HCOO]-	308.04837	171.8
[M+CH3COO]-	322.06402	168.3
[M+Na-2H]-	284.02484	166.6
[M]+	263.04962	159.2
[M]-	263.05072	159.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe