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(1S,2S,6R)-2-Benzyloxymethyl-7-methylene-3-oxa-9-tosylamidobicyclo[4.3.0]non-4-ene

View entire compound with spectra: 1 MS (GC)

(1S,2S,6R)-2-Benzyloxymethyl-7-methylene-3-oxa-9-tosylamidobicyclo[4.3.0]non-4-ene
SpectraBase Compound ID psbOX5gIkc
InChI InChI=1S/C23H23NO5S/c1-16-8-10-19(11-9-16)30(26,27)24-14-17(2)20-12-13-28-21(22(20)24)15-29-23(25)18-6-4-3-5-7-18/h3-13,20-22H,2,14-15H2,1H3/t20-,21?,22+/m1/s1
InChIKey AVDRXVSOQBNRIP-QFMSAKRMSA-N
Mol Weight 425.5 g/mol
Molecular Formula C23H23NO5S
Exact Mass 425.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTKGWVIzgEg
Name (1S,2S,6R)-2-Benzyloxymethyl-7-methylene-3-oxa-9-tosylamidobicyclo[4.3.0]non-4-ene
Alternate Name(s) Benzoic acid (3aR,7aS)-3-methylene-1-(toluene-4-sulfonyl)-1,2,3,3a,7,7a-hexahydro-pyrano[3,4-b]pyrrol-7-ylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO5S
InChI InChI=1S/C23H23NO5S/c1-16-8-10-19(11-9-16)30(26,27)24-14-17(2)20-12-13-28-21(22(20)24)15-29-23(25)18-6-4-3-5-7-18/h3-13,20-22H,2,14-15H2,1H3/t20-,21?,22+/m1/s1
InChIKey AVDRXVSOQBNRIP-QFMSAKRMSA-N
Molecular Weight 425.499 g/mol
SMILES [C@@]12(N(S(c3ccc(C)cc3)(=O)=O)CC([C@]1(C=COC2COC(=O)c1ccccc1)[H])=C)[H]
SPLASH splash10-00di-0091000000-7d1946fd71a610039486
Source of Spectrum F-53-3967-16
Wiley ID 801299