CID 64234

4-morpholinepropionamide, n-1-adamantyl-, monohydrochloride

Structural Information

Molecular Formula
C17H28N2O2
SMILES
C1COCCN1CCC(=O)NC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C17H28N2O2/c20-16(1-2-19-3-5-21-6-4-19)18-17-10-13-7-14(11-17)9-15(8-13)12-17/h13-15H,1-12H2,(H,18,20)
InChIKey
YUNYVNQCZMXLBU-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-3-morpholin-4-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

19
Patents

292.2151 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.222376 163.7
[M+Na]+ 315.204318 161.3
[M-H]- 291.207824 159.3
[M+NH4]+ 310.248923 182.1
[M+K]+ 331.178258 159.3
[M+H-H2O]+ 275.212360 154.2
[M+HCOO]- 337.213301 164.9
[M+CH3COO]- 351.228951 169.1
[M+Na-2H]- 313.189766 172.1
[M]+ 292.21455142 159.8
[M]- 292.21564858 159.8
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

patents stripe