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4-[N-(t-Butoxycarbonyl)amino]-4-[1'-(phenylsulfonyl)ethyl]-2,5-cyclohexadienone
SpectraBase Compound ID 46hVkkI8Ii
InChI InChI=1S/C19H23NO5S/c1-14(26(23,24)16-8-6-5-7-9-16)19(12-10-15(21)11-13-19)20-17(22)25-18(2,3)4/h5-14H,1-4H3,(H,20,22)
InChIKey URWJEKMIZIYSQF-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C19H23NO5S
Exact Mass 377.129694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LuKWxS2ZbE
Name 4-[N-(t-Butoxycarbonyl)amino]-4-[1'-(phenylsulfonyl)ethyl]-2,5-cyclohexadienone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO5S
InChI InChI=1S/C19H23NO5S/c1-14(26(23,24)16-8-6-5-7-9-16)19(12-10-15(21)11-13-19)20-17(22)25-18(2,3)4/h5-14H,1-4H3,(H,20,22)
InChIKey URWJEKMIZIYSQF-UHFFFAOYSA-N
Molecular Weight 377.455 g/mol
SMILES N(C(OC(C)(C)C)=O)C1(C(S(=O)(=O)c2ccccc2)C)C=CC(C=C1)=O
SPLASH splash10-0a4i-8900000000-c51c3c90fa14decf9791
Source of Spectrum QE-14-631-33
Wiley ID 1691866