CID 120827

3-(hydroxymethyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione

Structural Information

Molecular Formula
C10H16N2O3
SMILES
CC1CCC2(CC1)C(=O)N(C(=O)N2)CO
InChI
InChI=1S/C10H16N2O3/c1-7-2-4-10(5-3-7)8(14)12(6-13)9(15)11-10/h7,13H,2-6H2,1H3,(H,11,15)
InChIKey
KDSCHUFYKGKZPC-UHFFFAOYSA-N
Compound name
3-(hydroxymethyl)-8-methyl-1,3-diazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.11609 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.12337 148.0
[M+Na]+ 235.10531 155.1
[M-H]- 211.10881 148.1
[M+NH4]+ 230.14991 166.9
[M+K]+ 251.07925 151.8
[M+H-H2O]+ 195.11335 142.0
[M+HCOO]- 257.11429 162.5
[M+CH3COO]- 271.12994 180.0
[M+Na-2H]- 233.09076 149.4
[M]+ 212.11554 141.8
[M]- 212.11664 141.8
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.