CID 3057848

Brn 1503594

Structural Information

Molecular Formula
C21H30N2O3
SMILES
CCN(CCN1C(=O)CC2(C1=O)CCCC3=CC=CC=C23)CCOCC
InChI
InChI=1S/C21H30N2O3/c1-3-22(14-15-26-4-2)12-13-23-19(24)16-21(20(23)25)11-7-9-17-8-5-6-10-18(17)21/h5-6,8,10H,3-4,7,9,11-16H2,1-2H3
InChIKey
OXWXEOZDYYVOQU-UHFFFAOYSA-N
Compound name
1'-[2-[2-ethoxyethyl(ethyl)amino]ethyl]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

358.22565 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.23293 188.9
[M+Na]+ 381.21487 198.1
[M+NH4]+ 376.25947 197.2
[M+K]+ 397.18881 190.7
[M-H]- 357.21837 191.4
[M+Na-2H]- 379.20032 192.8
[M]+ 358.22510 190.8
[M]- 358.22620 190.8
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.