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]+ 317.18596 174.0
[M+Na]+ 339.16790 180.9
[M-H]- 315.17140 180.2
[M+NH4]+ 334.21250 192.9
[M+K]+ 355.14184 178.0
[M+H-H2O]+ 299.17594 166.4
[M+HCOO]- 361.17688 192.9
[M+CH3COO]- 375.19253 212.9
[M+Na-2H]- 337.15335 175.4
[M]+ 316.17813 174.8
[M]- 316.17923 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.