CID 43608

61356-02-3

Structural Information

Molecular Formula
C15H22N2O2
SMILES
C1CCN(CC1)CCN2C(=O)C3CC=CCC3C2=O
InChI
InChI=1S/C15H22N2O2/c18-14-12-6-2-3-7-13(12)15(19)17(14)11-10-16-8-4-1-5-9-16/h2-3,12-13H,1,4-11H2
InChIKey
MNWXFNOXUZLLGC-UHFFFAOYSA-N
Compound name
2-(2-piperidin-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.16812 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 164.4
[M+Na]+ 285.15734 174.3
[M+NH4]+ 280.20194 172.2
[M+K]+ 301.13128 169.3
[M-H]- 261.16084 166.5
[M+Na-2H]- 283.14279 167.1
[M]+ 262.16757 166.0
[M]- 262.16867 166.0
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.