CID 115546

63990-07-8

Structural Information

Molecular Formula
C12H18N2O3
SMILES
CC1C(C(C2(C1C)C(=O)NC(=O)NC2=O)C)C
InChI
InChI=1S/C12H18N2O3/c1-5-6(2)8(4)12(7(5)3)9(15)13-11(17)14-10(12)16/h5-8H,1-4H3,(H2,13,14,15,16,17)
InChIKey
HDFROCWFPCVJJQ-UHFFFAOYSA-N
Compound name
1,2,3,4-tetramethyl-7,9-diazaspiro[4.5]decane-6,8,10-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.13174 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.139016 153.5
[M+Na]+ 261.120958 162.8
[M-H]- 237.124464 154.4
[M+NH4]+ 256.165563 172.2
[M+K]+ 277.094898 158.5
[M+H-H2O]+ 221.129000 148.6
[M+HCOO]- 283.129941 167.4
[M+CH3COO]- 297.145591 189.2
[M+Na-2H]- 259.106406 152.2
[M]+ 238.13119142 148.6
[M]- 238.13228858 148.6
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.