CID 205118

17502-67-9

Structural Information

Molecular Formula
C18H24N2O3
SMILES
CN(C)CCN1C(=O)CC2(C1=O)CCCC3=C2C=CC(=C3)OC
InChI
InChI=1S/C18H24N2O3/c1-19(2)9-10-20-16(21)12-18(17(20)22)8-4-5-13-11-14(23-3)6-7-15(13)18/h6-7,11H,4-5,8-10,12H2,1-3H3
InChIKey
CAFJCRGOHBMILU-UHFFFAOYSA-N
Compound name
1'-[2-(dimethylamino)ethyl]-7-methoxyspiro[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

316.17868 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.185956 174.0
[M+Na]+ 339.167898 180.9
[M-H]- 315.171404 180.2
[M+NH4]+ 334.212503 192.9
[M+K]+ 355.141838 178.0
[M+H-H2O]+ 299.175940 166.4
[M+HCOO]- 361.176881 192.9
[M+CH3COO]- 375.192531 212.9
[M+Na-2H]- 337.153346 175.4
[M]+ 316.17813142 174.8
[M]- 316.17922858 174.8
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.