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Methyl (5S)-4-hydroxy-2-[(naphthalen-2'-yl)sulfonyl]-3-oxo-2-azabicyclo[2.2.2]oct-7-ene-5-carboxylate
SpectraBase Compound ID FM518p2r3KN
InChI InChI=1S/C19H17NO6S/c1-26-17(21)16-11-14-8-9-19(16,23)18(22)20(14)27(24,25)15-7-6-12-4-2-3-5-13(12)10-15/h2-10,14,16,23H,11H2,1H3/t14?,16-,19?/m1/s1
InChIKey NIEKEUOTSVVVOQ-NLGTXKQRSA-N
Mol Weight 387.41 g/mol
Molecular Formula C19H17NO6S
Exact Mass 387.077658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F509XLQ9qTN
Name Methyl (5S)-4-hydroxy-2-[(naphthalen-2'-yl)sulfonyl]-3-oxo-2-azabicyclo[2.2.2]oct-7-ene-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO6S
InChI InChI=1S/C19H17NO6S/c1-26-17(21)16-11-14-8-9-19(16,23)18(22)20(14)27(24,25)15-7-6-12-4-2-3-5-13(12)10-15/h2-10,14,16,23H,11H2,1H3/t14?,16-,19?/m1/s1
InChIKey NIEKEUOTSVVVOQ-NLGTXKQRSA-N
Molecular Weight 387.406 g/mol
SMILES OC12C(N(S(c3cc4ccccc4cc3)(=O)=O)C(C[C@@]2(C(=O)OC)[H])C=C1)=O
SPLASH splash10-0ufr-0910000000-13239b6427bb4b34c5e8
Source of Spectrum H-86-3807-27
Synonyms Methyl (5S)-4-hydroxy-2-(2-naphthylsulfonyl)-3-oxo-2-azabicyclo[2.2.2]oct-7-ene-5-carboxylate
Wiley ID 1525731