CID 380313

101607-43-6

Structural Information

Molecular Formula
C20H27N3O2
SMILES
C1CCN(CC1)N2C(=O)CC3(C2=O)CCN(CC3)CC4=CC=CC=C4
InChI
InChI=1S/C20H27N3O2/c24-18-15-20(19(25)23(18)22-11-5-2-6-12-22)9-13-21(14-10-20)16-17-7-3-1-4-8-17/h1,3-4,7-8H,2,5-6,9-16H2
InChIKey
MYPOMDOUBCVDOK-UHFFFAOYSA-N
Compound name
8-benzyl-2-piperidin-1-yl-2,8-diazaspiro[4.5]decane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.21033 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.217606 186.4
[M+Na]+ 364.199548 189.3
[M-H]- 340.203054 192.0
[M+NH4]+ 359.244153 198.4
[M+K]+ 380.173488 184.0
[M+H-H2O]+ 324.207590 174.2
[M+HCOO]- 386.208531 197.1
[M+CH3COO]- 400.224181 193.5
[M+Na-2H]- 362.184996 183.8
[M]+ 341.20978142 176.5
[M]- 341.21087858 176.5
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.