CID 3056658

Brn 1109606

Structural Information

Molecular Formula
C9H17N3OS
SMILES
CCN(CC)CC(=O)NC1=NCCS1
InChI
InChI=1S/C9H17N3OS/c1-3-12(4-2)7-8(13)11-9-10-5-6-14-9/h3-7H2,1-2H3,(H,10,11,13)
InChIKey
MONVZSXOSCKEMW-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-(4,5-dihydro-1,3-thiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.10924 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.11652 149.8
[M+Na]+ 238.09846 154.9
[M-H]- 214.10196 153.1
[M+NH4]+ 233.14306 169.4
[M+K]+ 254.07240 154.1
[M+H-H2O]+ 198.10650 142.3
[M+HCOO]- 260.10744 168.9
[M+CH3COO]- 274.12309 192.0
[M+Na-2H]- 236.08391 150.4
[M]+ 215.10869 151.4
[M]- 215.10979 151.4
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.