CID 581431

N-dodecyl-n'-thiazol-2-yl-oxalamide

Structural Information

Molecular Formula
C17H29N3O2S
SMILES
CCCCCCCCCCCCNC(=O)C(=O)NC1=NC=CS1
InChI
InChI=1S/C17H29N3O2S/c1-2-3-4-5-6-7-8-9-10-11-12-18-15(21)16(22)20-17-19-13-14-23-17/h13-14H,2-12H2,1H3,(H,18,21)(H,19,20,22)
InChIKey
RYBYKHDWYRKFEL-UHFFFAOYSA-N
Compound name
N-dodecyl-N'-(1,3-thiazol-2-yl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.19806 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.20534 185.3
[M+Na]+ 362.18728 187.6
[M-H]- 338.19078 186.1
[M+NH4]+ 357.23188 199.0
[M+K]+ 378.16122 183.7
[M+H-H2O]+ 322.19532 176.4
[M+HCOO]- 384.19626 202.2
[M+CH3COO]- 398.21191 213.4
[M+Na-2H]- 360.17273 182.8
[M]+ 339.19751 189.9
[M]- 339.19861 189.9
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.