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tert-butyl (1S,5R)-1-(4-chlorophenyl)-2-oxo-3-azabicyclo[3.1.0]hexane-3-carboxylate
SpectraBase Compound ID D4ZAwewaigz
InChI InChI=1S/C16H18ClNO3/c1-15(2,3)21-14(20)18-9-11-8-16(11,13(18)19)10-4-6-12(17)7-5-10/h4-7,11H,8-9H2,1-3H3/t11-,16+/m0/s1
InChIKey GEWDMRVMXOBBSX-MEDUHNTESA-N
Mol Weight 307.78 g/mol
Molecular Formula C16H18ClNO3
Exact Mass 307.097521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9WQW9p4Gk0g
Name tert-butyl (1S,5R)-1-(4-chlorophenyl)-2-oxo-3-azabicyclo[3.1.0]hexane-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C16H18ClNO3
InChI InChI=1S/C16H18ClNO3/c1-15(2,3)21-14(20)18-9-11-8-16(11,13(18)19)10-4-6-12(17)7-5-10/h4-7,11H,8-9H2,1-3H3/t11-,16+/m0/s1
InChIKey GEWDMRVMXOBBSX-MEDUHNTESA-N
Molecular Weight 307.777 g/mol
SMILES C1(N(C[C@]2([C@]1(c1ccc(cc1)Cl)C2)[H])C(OC(C)(C)C)=O)=O
SPLASH splash10-0zfr-0097000000-ea8bea11367eebd8ffc1
Source of Spectrum E2-47-1190-17
Synonyms (1S,5R)-1-(4-chlorophenyl)-2-oxo-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester tert-butyl (1S,5R)-1-(4-chlorophenyl)-2-oxidanylidene-3-azabicyclo[3.1.0]hexane-3-carboxylate
Wiley ID 1554928