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3-[(1S,6R)-6-(p-Tolylsulfonyl)bicyclo[4.1.0]hept-1-yl]propionamide
SpectraBase Compound ID I7Xj8JYSlRk
InChI InChI=1S/C17H23NO3S/c1-13-4-6-14(7-5-13)22(20,21)17-10-3-2-9-16(17,12-17)11-8-15(18)19/h4-7H,2-3,8-12H2,1H3,(H2,18,19)/t16-,17+/m0/s1
InChIKey WXKYAUSRXGRIJF-DLBZAZTESA-N
Mol Weight 321.44 g/mol
Molecular Formula C17H23NO3S
Exact Mass 321.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IX1sCCpWnbk
Name 3-[(1S,6R)-6-(p-Tolylsulfonyl)bicyclo[4.1.0]hept-1-yl]propionamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO3S
InChI InChI=1S/C17H23NO3S/c1-13-4-6-14(7-5-13)22(20,21)17-10-3-2-9-16(17,12-17)11-8-15(18)19/h4-7H,2-3,8-12H2,1H3,(H2,18,19)/t16-,17+/m0/s1
InChIKey WXKYAUSRXGRIJF-DLBZAZTESA-N
Molecular Weight 321.435 g/mol
SMILES NC(CC[C@@]12CCCC[C@]2(C1)S(=O)(=O)c1ccc(cc1)C)=O
SPLASH splash10-014j-0900000000-5dd7391fc4daa0fb02ab
Source of Spectrum E1-43-577-25
Synonyms 3-{(1S,6R)-6-[(4-methylphenyl)sulfonyl]bicyclo[4.1.0]hept-1-yl}propanamide
Wiley ID 1553005