CID 3057863

Brn 1551704

Structural Information

Molecular Formula
C20H28N2O3
SMILES
CN(CCCN1C(=O)CC2(C1=O)CCCC3=CC=CC=C23)CCOC
InChI
InChI=1S/C20H28N2O3/c1-21(13-14-25-2)11-6-12-22-18(23)15-20(19(22)24)10-5-8-16-7-3-4-9-17(16)20/h3-4,7,9H,5-6,8,10-15H2,1-2H3
InChIKey
BEDWVXBCUDAELZ-UHFFFAOYSA-N
Compound name
1'-[3-[2-methoxyethyl(methyl)amino]propyl]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

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.21728 183.5
[M+Na]+ 367.19922 188.5
[M-H]- 343.20272 188.8
[M+NH4]+ 362.24382 200.8
[M+K]+ 383.17316 185.1
[M+H-H2O]+ 327.20726 175.1
[M+HCOO]- 389.20820 201.6
[M+CH3COO]- 403.22385 217.6
[M+Na-2H]- 365.18467 184.3
[M]+ 344.20945 184.4
[M]- 344.21055 184.4
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.