CID 55279938

1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl chloride

Structural Information

Molecular Formula
C7H12ClNO4S
SMILES
C1CN(CCC12OCCO2)S(=O)(=O)Cl
InChI
InChI=1S/C7H12ClNO4S/c8-14(10,11)9-3-1-7(2-4-9)12-5-6-13-7/h1-6H2
InChIKey
BGZUFEVTVCKYMP-UHFFFAOYSA-N
Compound name
1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

241.01756 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.02484 147.4
[M+Na]+ 264.00678 156.7
[M+NH4]+ 259.05138 156.4
[M+K]+ 279.98072 151.3
[M-H]- 240.01028 149.9
[M+Na-2H]- 261.99223 151.2
[M]+ 241.01701 150.2
[M]- 241.01811 150.2
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