CID 68572736

1204294-41-6

Structural Information

Molecular Formula

C₉H₁₁NO₂S

SMILES

C1[C@H]([C@@H]1S(=O)(=O)N)C2=CC=CC=C2

InChI

InChI=1S/C9H11NO2S/c10-13(11,12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H2,10,11,12)/t8-,9+/m0/s1

InChIKey

XNACGRLKLDYUKR-DTWKUNHWSA-N

Compound name

(1R,2S)-2-phenylcyclopropane-1-sulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 197.05106 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]+	198.05834	144.6
[M+Na]+	220.04028	157.1
[M+NH4]+	215.08488	153.5
[M+K]+	236.01422	151.3
[M-H]-	196.04378	154.2
[M+Na-2H]-	218.02573	153.6
[M]+	197.05051	150.6
[M]-	197.05161	150.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe