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]+ 293.22238 163.7
[M+Na]+ 315.20432 161.3
[M-H]- 291.20782 159.3
[M+NH4]+ 310.24892 182.1
[M+K]+ 331.17826 159.3
[M+H-H2O]+ 275.21236 154.2
[M+HCOO]- 337.21330 164.9
[M+CH3COO]- 351.22895 169.1
[M+Na-2H]- 313.18977 172.1
[M]+ 292.21455 159.8
[M]- 292.21565 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.