CID 3057882

Brn 1551706

Structural Information

Molecular Formula
C20H28N2O3
SMILES
CN(CCCCN1C(=O)CC2(C1=O)CCCC3=CC=CC=C23)CCO
InChI
InChI=1S/C20H28N2O3/c1-21(13-14-23)11-4-5-12-22-18(24)15-20(19(22)25)10-6-8-16-7-2-3-9-17(16)20/h2-3,7,9,23H,4-6,8,10-15H2,1H3
InChIKey
MSJNXOZCEKXFDQ-UHFFFAOYSA-N
Compound name
1'-[4-[2-hydroxyethyl(methyl)amino]butyl]spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

344.21 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.21728 184.7
[M+Na]+ 367.19922 193.6
[M+NH4]+ 362.24382 192.9
[M+K]+ 383.17316 186.8
[M-H]- 343.20272 186.7
[M+Na-2H]- 365.18467 188.3
[M]+ 344.20945 186.4
[M]- 344.21055 186.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.