CID 217650

8-thia-1,3-diazaspiro[4.5]decane-2,4-dione

Structural Information

Molecular Formula
C7H10N2O2S
SMILES
C1CSCCC12C(=O)NC(=O)N2
InChI
InChI=1S/C7H10N2O2S/c10-5-7(9-6(11)8-5)1-3-12-4-2-7/h1-4H2,(H2,8,9,10,11)
InChIKey
GQPALRFORJWKIG-UHFFFAOYSA-N
Compound name
8-thia-1,3-diazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8
Patents

186.0463 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.053576 139.2
[M+Na]+ 209.035518 146.2
[M-H]- 185.039024 139.1
[M+NH4]+ 204.080123 159.3
[M+K]+ 225.009458 142.5
[M+H-H2O]+ 169.043560 133.8
[M+HCOO]- 231.044501 149.6
[M+CH3COO]- 245.060151 150.2
[M+Na-2H]- 207.020966 140.6
[M]+ 186.04575142 132.4
[M]- 186.04684858 132.4
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

patents stripe