CID 24845447

Brn 1317980

Structural Information

Molecular Formula
C16H28N2O2
SMILES
CC1(C2CCC(O1)(C(C2)NCC(=O)N3CCCC3)C)C
InChI
InChI=1S/C16H28N2O2/c1-15(2)12-6-7-16(3,20-15)13(10-12)17-11-14(19)18-8-4-5-9-18/h12-13,17H,4-11H2,1-3H3
InChIKey
PRAALQBOGYBXJG-UHFFFAOYSA-N
Compound name
1-pyrrolidin-1-yl-2-[(1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan-6-yl)amino]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.2151 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.22238 167.1
[M+Na]+ 303.20432 173.9
[M+NH4]+ 298.24892 179.1
[M+K]+ 319.17826 166.0
[M-H]- 279.20782 167.0
[M+Na-2H]- 301.18977 165.3
[M]+ 280.21455 168.1
[M]- 280.21565 168.1
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.