CID 2870779

Cambridge id 5812606

Structural Information

Molecular Formula
C15H19N3O2S
SMILES
C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C(=O)N
InChI
InChI=1S/C15H19N3O2S/c16-12(19)13(20)18-14-17-11(7-21-14)15-4-8-1-9(5-15)3-10(2-8)6-15/h7-10H,1-6H2,(H2,16,19)(H,17,18,20)
InChIKey
ICDQYROAJOSYJG-UHFFFAOYSA-N
Compound name
N'-[4-(1-adamantyl)-1,3-thiazol-2-yl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

305.1198 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.127076 161.9
[M+Na]+ 328.109018 163.4
[M-H]- 304.112524 157.8
[M+NH4]+ 323.153623 183.7
[M+K]+ 344.082958 160.9
[M+H-H2O]+ 288.117060 156.7
[M+HCOO]- 350.118001 164.8
[M+CH3COO]- 364.133651 169.1
[M+Na-2H]- 326.094466 169.6
[M]+ 305.11925142 163.4
[M]- 305.12034858 163.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.