CID 3059311

76311-55-2

Structural Information

Molecular Formula
C16H19ClN2O2
SMILES
CNCCN1C(=O)CC2(C1=O)CCCC3=C2C=C(C=C3)Cl
InChI
InChI=1S/C16H19ClN2O2/c1-18-7-8-19-14(20)10-16(15(19)21)6-2-3-11-4-5-12(17)9-13(11)16/h4-5,9,18H,2-3,6-8,10H2,1H3
InChIKey
HLKCJXWYHZEBIN-UHFFFAOYSA-N
Compound name
6-chloro-1'-[2-(methylamino)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

306.1135 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.12078 168.8
[M+Na]+ 329.10272 180.6
[M+NH4]+ 324.14732 178.6
[M+K]+ 345.07666 172.7
[M-H]- 305.10622 171.8
[M+Na-2H]- 327.08817 174.1
[M]+ 306.11295 171.6
[M]- 306.11405 171.6
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.