CID 120342

1,3-diazaspiro(4.7)dodecane-2,4-dione, 3-methyl-

Structural Information

Molecular Formula
C11H18N2O2
SMILES
CN1C(=O)C2(CCCCCCC2)NC1=O
InChI
InChI=1S/C11H18N2O2/c1-13-9(14)11(12-10(13)15)7-5-3-2-4-6-8-11/h2-8H2,1H3,(H,12,15)
InChIKey
DEXRKTJGIUDXLF-UHFFFAOYSA-N
Compound name
3-methyl-1,3-diazaspiro[4.7]dodecane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.13683 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.144106 161.8
[M+Na]+ 233.126048 166.3
[M-H]- 209.129554 162.5
[M+NH4]+ 228.170653 170.4
[M+K]+ 249.099988 165.8
[M+H-H2O]+ 193.134090 157.5
[M+HCOO]- 255.135031 168.3
[M+CH3COO]- 269.150681 221.6
[M+Na-2H]- 231.111496 159.7
[M]+ 210.13628142 158.4
[M]- 210.13737858 158.4
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.