CID 3073460

Acetamide, n-(9,10-dihydro-10-methyl-9-thioxo-1-acridinyl)-

Structural Information

Molecular Formula
C16H14N2OS
SMILES
CC(=O)NC1=C2C(=CC=C1)N(C3=CC=CC=C3C2=S)C
InChI
InChI=1S/C16H14N2OS/c1-10(19)17-12-7-5-9-14-15(12)16(20)11-6-3-4-8-13(11)18(14)2/h3-9H,1-2H3,(H,17,19)
InChIKey
NMFLZXAHPKPRBT-UHFFFAOYSA-N
Compound name
N-(10-methyl-9-sulfanylideneacridin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.08267 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.08995 160.5
[M+Na]+ 305.07189 171.9
[M-H]- 281.07539 165.6
[M+NH4]+ 300.11649 178.2
[M+K]+ 321.04583 165.5
[M+H-H2O]+ 265.07993 153.3
[M+HCOO]- 327.08087 177.8
[M+CH3COO]- 341.09652 173.0
[M+Na-2H]- 303.05734 166.5
[M]+ 282.08212 164.9
[M]- 282.08322 164.9
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.