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Benzyl (1S*,5R*)-6-benzol-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylate
SpectraBase Compound ID LfgHreRU9e5
InChI InChI=1S/C21H17NO4/c23-19(15-9-5-2-6-10-15)22-17-12-11-16(18(17)20(22)24)21(25)26-13-14-7-3-1-4-8-14/h1-11,17-18H,12-13H2
InChIKey XSDMXJLZPWTJMB-UHFFFAOYSA-N
Mol Weight 347.37 g/mol
Molecular Formula C21H17NO4
Exact Mass 347.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fyZMXDubLS
Name Benzyl (1S*,5R*)-6-benzol-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylate
Alternate Name(s) Benzyl-6-benzol-7-oxo-6-azabicyclo[3.2.0]hept-2-en-2-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NO4
InChI InChI=1S/C21H17NO4/c23-19(15-9-5-2-6-10-15)22-17-12-11-16(18(17)20(22)24)21(25)26-13-14-7-3-1-4-8-14/h1-11,17-18H,12-13H2
InChIKey XSDMXJLZPWTJMB-UHFFFAOYSA-N
Molecular Weight 347.370 g/mol
SMILES C1(N(C2C1C(=CC2)C(OCc1ccccc1)=O)C(=O)c1ccccc1)=O
SPLASH splash10-0udi-0091000000-d95ee97442e3113bae70
Source of Spectrum F-50-12060-14
Wiley ID 789890