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Benzeneacetic acid, 2-[2-[(3-chlorobenzoyl)oxy]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-3-ylidene]ethyl ester, [2S-(2.alpha.,3Z,5.alpha.)]-

View entire compound with spectra: 1 MS (GC)

Benzeneacetic acid, 2-[2-[(3-chlorobenzoyl)oxy]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-3-ylidene]ethyl ester, [2S-(2.alpha.,3Z,5.alpha.)]-
SpectraBase Compound ID 7YTGzJN4G8m
InChI InChI=1S/C22H18ClNO6/c23-16-8-4-7-15(12-16)22(27)30-21-17(29-19-13-18(25)24(19)21)9-10-28-20(26)11-14-5-2-1-3-6-14/h1-9,12,19,21H,10-11,13H2/b17-9-
InChIKey GIBVHXIYDMJCIO-MFOYZWKCSA-N
Mol Weight 427.84 g/mol
Molecular Formula C22H18ClNO6
Exact Mass 427.082265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DkI3Z1kdlF
Name Benzeneacetic acid, 2-[2-[(3-chlorobenzoyl)oxy]-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-3-ylidene]ethyl ester, [2S-(2.alpha.,3Z,5.alpha.)]-
CAS Registry Number 71916-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClNO6
InChI InChI=1S/C22H18ClNO6/c23-16-8-4-7-15(12-16)22(27)30-21-17(29-19-13-18(25)24(19)21)9-10-28-20(26)11-14-5-2-1-3-6-14/h1-9,12,19,21H,10-11,13H2/b17-9-
InChIKey GIBVHXIYDMJCIO-MFOYZWKCSA-N
Molecular Weight 427.840 g/mol
SMILES C1(N2C(O\C1=C\COC(=O)Cc1ccccc1)CC2=O)OC(c1cc(Cl)ccc1)=O
SPLASH splash10-000l-4900000000-5178b446a5775732f18d
Source of Spectrum KC-1983-2517-0
Synonyms (3Z)-7-oxo-3-{2-[(phenylacetyl)oxy]ethylidene}-4-oxa-1-azabicyclo[3.2.0]hept-2-yl 3-chlorobenzoate (Z)-(3S,5R)-3-(m-chlorobenzoyloxy)-2-(2-phenylacetoxyethylidene)clavam 4-Oxa-1-azabicyclo[3.2.0]heptane, benzeneacetic acid deriv.
Wiley ID 1380367