CID 3034563

67196-33-2

Structural Information

Molecular Formula
C10H14N2O2S
SMILES
CC1CCCCC12C(=O)NC(=S)NC2=O
InChI
InChI=1S/C10H14N2O2S/c1-6-4-2-3-5-10(6)7(13)11-9(15)12-8(10)14/h6H,2-5H2,1H3,(H2,11,12,13,14,15)
InChIKey
KGDCIRWEMPZYQW-UHFFFAOYSA-N
Compound name
11-methyl-3-sulfanylidene-2,4-diazaspiro[5.5]undecane-1,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.0776 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.08488 151.4
[M+Na]+ 249.06682 160.8
[M+NH4]+ 244.11142 159.7
[M+K]+ 265.04076 151.8
[M-H]- 225.07032 151.6
[M+Na-2H]- 247.05227 154.8
[M]+ 226.07705 153.0
[M]- 226.07815 153.0
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.