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1-(2'-Nitrobenzyl)-2-(2'-phenylsulfonylethyl)-8-oxo-2-aza-3,7-dioxabicyclo[3.3.0]octane
SpectraBase Compound ID L2sy9wydCtn
InChI InChI=1S/C20H20N2O7S/c23-19-20(12-15-6-4-5-9-18(15)22(24)25)16(13-28-19)14-29-21(20)10-11-30(26,27)17-7-2-1-3-8-17/h1-9,16H,10-14H2
InChIKey HZECKCUATUQCEY-UHFFFAOYSA-N
Mol Weight 432.45 g/mol
Molecular Formula C20H20N2O7S
Exact Mass 432.099122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6UwvNSJSB27
Name 1-(2'-Nitrobenzyl)-2-(2'-phenylsulfonylethyl)-8-oxo-2-aza-3,7-dioxabicyclo[3.3.0]octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O7S
InChI InChI=1S/C20H20N2O7S/c23-19-20(12-15-6-4-5-9-18(15)22(24)25)16(13-28-19)14-29-21(20)10-11-30(26,27)17-7-2-1-3-8-17/h1-9,16H,10-14H2
InChIKey HZECKCUATUQCEY-UHFFFAOYSA-N
Molecular Weight 432.447 g/mol
SMILES C12(N(OCC2COC1=O)CCS(=O)(=O)c1ccccc1)Cc1c(N(=O)=O)cccc1
SPLASH splash10-004i-9420000000-57ff9310725069a6418e
Source of Spectrum F-47-4510-5
Synonyms 6a-(2-nitrobenzyl)-1-[2-(phenylsulfonyl)ethyl]tetrahydro-3H,6H-furo[3,4-c]isoxazol-6-one
Wiley ID 1382150