CID 3078433

9(10h)-acridinethione, 1-amino-10-methyl-

Structural Information

Molecular Formula
C14H12N2S
SMILES
CN1C2=CC=CC=C2C(=S)C3=C(C=CC=C31)N
InChI
InChI=1S/C14H12N2S/c1-16-11-7-3-2-5-9(11)14(17)13-10(15)6-4-8-12(13)16/h2-8H,15H2,1H3
InChIKey
LYKWYJBZORQQLV-UHFFFAOYSA-N
Compound name
1-amino-10-methylacridine-9-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.07211 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.07939 148.8
[M+Na]+ 263.06133 161.5
[M-H]- 239.06483 153.7
[M+NH4]+ 258.10593 168.2
[M+K]+ 279.03527 154.6
[M+H-H2O]+ 223.06937 142.2
[M+HCOO]- 285.07031 166.9
[M+CH3COO]- 299.08596 162.3
[M+Na-2H]- 261.04678 155.8
[M]+ 240.07156 151.6
[M]- 240.07266 151.6
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.