CID 56190

Brn 0983445

Structural Information

Molecular Formula
C10H17N3OS
SMILES
CCN(CC)CC(=O)NC1=CC(=NS1)C
InChI
InChI=1S/C10H17N3OS/c1-4-13(5-2)7-9(14)11-10-6-8(3)12-15-10/h6H,4-5,7H2,1-3H3,(H,11,14)
InChIKey
POULGNYMQCFWMF-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(3-methyl-1,2-thiazol-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.10924 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.11652 152.4
[M+Na]+ 250.09846 158.9
[M-H]- 226.10196 156.3
[M+NH4]+ 245.14306 171.8
[M+K]+ 266.07240 157.6
[M+H-H2O]+ 210.10650 145.0
[M+HCOO]- 272.10744 172.6
[M+CH3COO]- 286.12309 196.4
[M+Na-2H]- 248.08391 152.8
[M]+ 227.10869 156.3
[M]- 227.10979 156.3
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.