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3-[(2..xi.)-2-[(1.xi.,3S,5R)-3,5-Dimethyl-2-methylenecyclopentyl]-1-oxo]propyl-1-(phenylsulfonyl)-1H-pyrrole
SpectraBase Compound ID DaUyKDhuEfd
InChI InChI=1S/C21H25NO3S/c1-14-12-15(2)20(16(14)3)17(4)21(23)18-10-11-22(13-18)26(24,25)19-8-6-5-7-9-19/h5-11,13-15,17,20H,3,12H2,1-2,4H3/t14-,15+,17?,20?/m0/s1
InChIKey WUJAZJCMOPUZHL-RGWHHRAMSA-N
Mol Weight 371.5 g/mol
Molecular Formula C21H25NO3S
Exact Mass 371.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Qvo12YyxCw
Name 3-[(2..xi.)-2-[(1.xi.,3S,5R)-3,5-Dimethyl-2-methylenecyclopentyl]-1-oxo]propyl-1-(phenylsulfonyl)-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO3S
InChI InChI=1S/C21H25NO3S/c1-14-12-15(2)20(16(14)3)17(4)21(23)18-10-11-22(13-18)26(24,25)19-8-6-5-7-9-19/h5-11,13-15,17,20H,3,12H2,1-2,4H3/t14-,15+,17?,20?/m0/s1
InChIKey WUJAZJCMOPUZHL-RGWHHRAMSA-N
Molecular Weight 371.495 g/mol
SMILES c1[n](S(=O)(=O)c2ccccc2)ccc1C(C(C1C([C@@](C)(C[C@]1(C)[H])[H])=C)C)=O
SPLASH splash10-01si-7190000000-c51dcdf503071ba9c266
Source of Spectrum E1-42-860-26
Wiley ID 1552549