CID 202397

10288-31-0

Structural Information

Molecular Formula
C10H13NO2S
SMILES
C=CCN1C(=O)CC2(C1=O)CCSC2
InChI
InChI=1S/C10H13NO2S/c1-2-4-11-8(12)6-10(9(11)13)3-5-14-7-10/h2H,1,3-7H2
InChIKey
HZYYQZHCTSRLPC-UHFFFAOYSA-N
Compound name
2-prop-2-enyl-7-thia-2-azaspiro[4.4]nonane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.0667 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.07398 150.1
[M+Na]+ 234.05592 158.3
[M+NH4]+ 229.10052 159.5
[M+K]+ 250.02986 152.2
[M-H]- 210.05942 150.7
[M+Na-2H]- 232.04137 153.2
[M]+ 211.06615 151.7
[M]- 211.06725 151.7
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.