N-[(1R,2S,3R,5R)-2,3-Dihydroxy-5-(2-methylphenyl)cyclopentyl]methanesulfonamide

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Systematic / IUPAC Name:

ID: Reference12990

Other Names: NAT38-536288

Formula: C13H19NO4S

Spectral Data

N-[(1R,2S,3R,5R)-2,3-Dihydroxy-5-(2-methylphenyl)cyclopentyl]methanesulfonamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2384
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 1/30/2024 5:48:21 PM
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Identificators

InChI InChI=1S/C13H19NO4S/c1-8-5-3-4-6-9(8)10-7-11(15)13(16)12(10)14-19(2,17)18/h3-6,10-16H,7H2,1-2H3/t10-,11-,12-,13-/m1/s1
InChI Key HPBIHFVGKLXFER-FDYHWXHSSA-N
Canonical SMILES CC1=CC=CC=C1C2CC(C(C2NS(=O)(=O)C)O)O
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Other Names NAT38-536288

In Other Databases

ChEMBL CHEMBL4925601
PubChem 71693803
ChemSpider 29853005