CID 3057857

74246-82-5

Structural Information

Molecular Formula
C20H26N2O2
SMILES
C1CCN(C1)CCCN2C(=O)CC3(C2=O)CCCC4=CC=CC=C34
InChI
InChI=1S/C20H26N2O2/c23-18-15-20(10-5-8-16-7-1-2-9-17(16)20)19(24)22(18)14-6-13-21-11-3-4-12-21/h1-2,7,9H,3-6,8,10-15H2
InChIKey
LSOCDNZZTOQGBO-UHFFFAOYSA-N
Compound name
1'-(3-pyrrolidin-1-ylpropyl)spiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

326.19943 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.206706 182.0
[M+Na]+ 349.188648 187.1
[M-H]- 325.192154 187.8
[M+NH4]+ 344.233253 199.6
[M+K]+ 365.162588 181.5
[M+H-H2O]+ 309.196690 172.7
[M+HCOO]- 371.197631 196.4
[M+CH3COO]- 385.213281 191.0
[M+Na-2H]- 347.174096 179.4
[M]+ 326.19888142 176.8
[M]- 326.19997858 176.8
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.