CID 104580

1-(n-(2-furylmethyl)glycyl)-2,2,6,6-tetramethylpiperidine

Structural Information

Molecular Formula
C16H26N2O2
SMILES
CC1(CCCC(N1CC(=O)NCC2=CC=CO2)(C)C)C
InChI
InChI=1S/C16H26N2O2/c1-15(2)8-6-9-16(3,4)18(15)12-14(19)17-11-13-7-5-10-20-13/h5,7,10H,6,8-9,11-12H2,1-4H3,(H,17,19)
InChIKey
QXWWEACWIMHXFM-UHFFFAOYSA-N
Compound name
N-(furan-2-ylmethyl)-2-(2,2,6,6-tetramethylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.19943 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.20671 165.6
[M+Na]+ 301.18865 171.2
[M-H]- 277.19215 171.1
[M+NH4]+ 296.23325 184.5
[M+K]+ 317.16259 170.0
[M+H-H2O]+ 261.19669 159.2
[M+HCOO]- 323.19763 184.3
[M+CH3COO]- 337.21328 201.5
[M+Na-2H]- 299.17410 168.4
[M]+ 278.19888 165.3
[M]- 278.19998 165.3
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.