CID 3079747

Brn 4760274

Structural Information

Molecular Formula
C16H15N3O2S
SMILES
COC1=CC2=C(C3=CC=CC=C3N=C2C=C1)SCC(=O)NN
InChI
InChI=1S/C16H15N3O2S/c1-21-10-6-7-14-12(8-10)16(22-9-15(20)19-17)11-4-2-3-5-13(11)18-14/h2-8H,9,17H2,1H3,(H,19,20)
InChIKey
GAEVJAWMAJSEPT-UHFFFAOYSA-N
Compound name
2-(2-methoxyacridin-9-yl)sulfanylacetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.0885 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.09578 168.1
[M+Na]+ 336.07772 181.7
[M+NH4]+ 331.12232 176.5
[M+K]+ 352.05166 172.2
[M-H]- 312.08122 172.1
[M+Na-2H]- 334.06317 174.9
[M]+ 313.08795 171.6
[M]- 313.08905 171.6
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.