CID 64218

Morpholinium, ((1-adamantylcarbamoyl)methyl)-4-methyl-, iodide

Structural Information

Molecular Formula
C17H29N2O2
SMILES
C[N+]1(CCOCC1)CC(=O)NC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C17H28N2O2/c1-19(2-4-21-5-3-19)12-16(20)18-17-9-13-6-14(10-17)8-15(7-13)11-17/h13-15H,2-12H2,1H3/p+1
InChIKey
SCFWPZJCDOXZGS-UHFFFAOYSA-O
Compound name
N-(1-adamantyl)-2-(4-methylmorpholin-4-ium-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.2229 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.230176 162.4
[M+Na]+ 316.212118 160.9
[M-H]- 292.215624 158.5
[M+NH4]+ 311.256723 182.6
[M+K]+ 332.186058 153.4
[M+H-H2O]+ 276.220160 155.0
[M+HCOO]- 338.221101 163.1
[M+CH3COO]- 352.236751 203.5
[M+Na-2H]- 314.197566 173.7
[M]+ 293.22235142 157.3
[M]- 293.22344858 157.3
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.