CID 3072300

Acetamide, 2-(methyl(phenylmethyl)amino)-n-(5-methyl-1,3,4-thiadiazol-2-yl)-

Structural Information

Molecular Formula
C13H16N4OS
SMILES
CC1=NN=C(S1)NC(=O)CN(C)CC2=CC=CC=C2
InChI
InChI=1S/C13H16N4OS/c1-10-15-16-13(19-10)14-12(18)9-17(2)8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3,(H,14,16,18)
InChIKey
XYALXNFXIIVWPJ-UHFFFAOYSA-N
Compound name
2-[benzyl(methyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.1045 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.111776 162.4
[M+Na]+ 299.093718 169.2
[M-H]- 275.097224 168.2
[M+NH4]+ 294.138323 178.2
[M+K]+ 315.067658 166.3
[M+H-H2O]+ 259.101760 153.4
[M+HCOO]- 321.102701 182.2
[M+CH3COO]- 335.118351 203.6
[M+Na-2H]- 297.079166 164.2
[M]+ 276.10395142 165.6
[M]- 276.10504858 165.6
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.