CID 37395

Icr 378

Structural Information

Molecular Formula
C19H21ClN2OS
SMILES
COC1=CC2=C(C3=CC=CC=C3N=C2C=C1)NCCCSCCCl
InChI
InChI=1S/C19H21ClN2OS/c1-23-14-7-8-18-16(13-14)19(21-10-4-11-24-12-9-20)15-5-2-3-6-17(15)22-18/h2-3,5-8,13H,4,9-12H2,1H3,(H,21,22)
InChIKey
JKZAUMXLZORDAZ-UHFFFAOYSA-N
Compound name
N-[3-(2-chloroethylsulfanyl)propyl]-2-methoxyacridin-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.10632 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.11360 182.2
[M+Na]+ 383.09554 198.5
[M+NH4]+ 378.14014 192.1
[M+K]+ 399.06948 185.4
[M-H]- 359.09904 187.1
[M+Na-2H]- 381.08099 189.8
[M]+ 360.10577 187.0
[M]- 360.10687 187.0
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.