CID 11117728

17060-95-6

Structural Information

Molecular Formula

C₇H₁₂ClNO₃S

SMILES

CC1(C(=O)N(C1(C)C)S(=O)(=O)Cl)C

InChI

InChI=1S/C7H12ClNO3S/c1-6(2)5(10)9(7(6,3)4)13(8,11)12/h1-4H3

InChIKey

SQJSTWDZTOWGRY-UHFFFAOYSA-N

Compound name

2,2,3,3-tetramethyl-4-oxoazetidine-1-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 225.02264 Da
Monoisotopic Mass: 1.3
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]+	226.02992	141.8
[M+Na]+	248.01186	148.2
[M+NH4]+	243.05646	147.3
[M+K]+	263.98580	141.2
[M-H]-	224.01536	137.8
[M+Na-2H]-	245.99731	145.3
[M]+	225.02209	141.3
[M]-	225.02319	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe