CID 3063631

101275-49-4

Structural Information

Molecular Formula
C16H22N2O3
SMILES
C1CC(=O)N(C(=O)C1)CCCCCOC2=CC=C(C=C2)N
InChI
InChI=1S/C16H22N2O3/c17-13-7-9-14(10-8-13)21-12-3-1-2-11-18-15(19)5-4-6-16(18)20/h7-10H,1-6,11-12,17H2
InChIKey
HNZIWGCJGAAUJN-UHFFFAOYSA-N
Compound name
1-[5-(4-aminophenoxy)pentyl]piperidine-2,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.16306 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.170336 168.7
[M+Na]+ 313.152278 173.6
[M-H]- 289.155784 172.6
[M+NH4]+ 308.196883 182.1
[M+K]+ 329.126218 169.8
[M+H-H2O]+ 273.160320 159.8
[M+HCOO]- 335.161261 188.2
[M+CH3COO]- 349.176911 204.1
[M+Na-2H]- 311.137726 170.1
[M]+ 290.16251142 167.1
[M]- 290.16360858 167.1
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.