CID 138039655

Spiro[3.5]nonane-7-sulfonyl chloride

Structural Information

Molecular Formula

C₉H₁₅ClO₂S

SMILES

C1CC2(C1)CCC(CC2)S(=O)(=O)Cl

InChI

InChI=1S/C9H15ClO2S/c10-13(11,12)8-2-6-9(7-3-8)4-1-5-9/h8H,1-7H2

InChIKey

UDKSTTCXBVLBIF-UHFFFAOYSA-N

Compound name

spiro[3.5]nonane-7-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 222.04813 Da
Monoisotopic Mass: 3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	223.05541	138.7
[M+Na]+	245.03735	144.6
[M+NH4]+	240.08195	145.5
[M+K]+	261.01129	137.6
[M-H]-	221.04085	137.8
[M+Na-2H]-	243.02280	142.9
[M]+	222.04758	139.0
[M]-	222.04868	139.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe