CID 670622

303090-82-6

Structural Information

Molecular Formula
C13H15N3O2S2
SMILES
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)C
InChI
InChI=1S/C13H15N3O2S2/c1-3-18-11-6-4-10(5-7-11)14-12(17)8-19-13-16-15-9(2)20-13/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKey
OGFFQISKVNNNGX-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.06058 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.06786 167.6
[M+Na]+ 332.04980 178.1
[M+NH4]+ 327.09440 174.8
[M+K]+ 348.02374 170.1
[M-H]- 308.05330 170.3
[M+Na-2H]- 330.03525 172.9
[M]+ 309.06003 170.6
[M]- 309.06113 170.6
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.