CID 3072301

Brn 4874448

Structural Information

Molecular Formula
C14H18N4OS
SMILES
CCC1=NN=C(S1)NC(=O)CN(C)CC2=CC=CC=C2
InChI
InChI=1S/C14H18N4OS/c1-3-13-16-17-14(20-13)15-12(19)10-18(2)9-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,15,17,19)
InChIKey
FIZVNILUSSJCGF-UHFFFAOYSA-N
Compound name
2-[benzyl(methyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.12012 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.12740 166.4
[M+Na]+ 313.10934 176.4
[M+NH4]+ 308.15394 173.5
[M+K]+ 329.08328 170.3
[M-H]- 289.11284 169.8
[M+Na-2H]- 311.09479 173.1
[M]+ 290.11957 169.0
[M]- 290.12067 169.0
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.