CID 132302826

2195750-83-3

Structural Information

Molecular Formula
C12H19FN2O4S
SMILES
C1CCCC2(CCC1)C(=O)N(C(=O)N2)CCS(=O)(=O)F
InChI
InChI=1S/C12H19FN2O4S/c13-20(18,19)9-8-15-10(16)12(14-11(15)17)6-4-2-1-3-5-7-12/h1-9H2,(H,14,17)
InChIKey
OVJKBIIAKMFKNQ-UHFFFAOYSA-N
Compound name
2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)ethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.10495 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.112226 169.5
[M+Na]+ 329.094168 174.1
[M-H]- 305.097674 169.7
[M+NH4]+ 324.138773 176.7
[M+K]+ 345.068108 173.4
[M+H-H2O]+ 289.102210 165.5
[M+HCOO]- 351.103151 173.0
[M+CH3COO]- 365.118801 227.0
[M+Na-2H]- 327.079616 166.7
[M]+ 306.10440142 167.5
[M]- 306.10549858 167.5
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.