CID 16774078

1-(2-methylfuran-3-carbonyl)piperidin-4-amine hydrochloride

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CC1=C(C=CO1)C(=O)N2CCC(CC2)N
InChI
InChI=1S/C11H16N2O2/c1-8-10(4-7-15-8)11(14)13-5-2-9(12)3-6-13/h4,7,9H,2-3,5-6,12H2,1H3
InChIKey
ARUYSXQPPXDCNA-UHFFFAOYSA-N
Compound name
(4-aminopiperidin-1-yl)-(2-methylfuran-3-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 147.5
[M+Na]+ 231.11041 153.3
[M-H]- 207.11391 152.7
[M+NH4]+ 226.15501 164.8
[M+K]+ 247.08435 152.2
[M+H-H2O]+ 191.11845 140.3
[M+HCOO]- 253.11939 167.1
[M+CH3COO]- 267.13504 186.6
[M+Na-2H]- 229.09586 149.1
[M]+ 208.12064 143.6
[M]- 208.12174 143.6
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.