CID 155819334

2172265-06-2

Structural Information

Molecular Formula

C₆H₁₁NO₄S

SMILES

COC(=O)C1(CC1)CS(=O)(=O)N

InChI

InChI=1S/C6H11NO4S/c1-11-5(8)6(2-3-6)4-12(7,9)10/h2-4H2,1H3,(H2,7,9,10)

InChIKey

DAPTVWLENMABTN-UHFFFAOYSA-N

Compound name

methyl 1-(sulfamoylmethyl)cyclopropane-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 193.04088 Da
Monoisotopic Mass: -0.9
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]+	194.048156	137.1
[M+Na]+	216.030098	146.2
[M-H]-	192.033604	141.4
[M+NH4]+	211.074703	153.3
[M+K]+	232.004038	144.4
[M+H-H2O]+	176.038140	132.8
[M+HCOO]-	238.039081	154.6
[M+CH3COO]-	252.054731	182.4
[M+Na-2H]-	214.015546	142.0
[M]+	193.04033142	142.8
[M]-	193.04142858	142.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe