(2S,5R,6S)-6-hydroxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester

SpectraBase Compound ID	Gf5alzq2CYl
InChI	InChI=1S/C15H17NO4S/c1-15(2)11(16-12(18)10(17)13(16)21-15)14(19)20-8-9-6-4-3-5-7-9/h3-7,10-11,13,17H,8H2,1-2H3/t10-,11-,13+/m0/s1
InChIKey	XZNVUJIUQOYXIH-GMXVVIOVSA-N Google Search
Mol Weight	307.36 g/mol
Molecular Formula	C15H17NO4S
Exact Mass	307.087829 g/mol

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SpectraBase Spectrum ID	4cn2lehZRSy
Name	(2S,5R,6S)-6-hydroxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester
Alternate Name(s)	(2S,5R,6S)-6-hydroxy-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester (phenylmethyl) (2S,5R,6S)-3,3-dimethyl-6-oxidanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate benzyl (2S,5R,6S)-6-hydroxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS Registry Number	51056-25-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H17NO4S
InChI	InChI=1S/C15H17NO4S/c1-15(2)11(16-12(18)10(17)13(16)21-15)14(19)20-8-9-6-4-3-5-7-9/h3-7,10-11,13,17H,8H2,1-2H3/t10-,11-,13+/m0/s1
InChIKey	XZNVUJIUQOYXIH-GMXVVIOVSA-N
Molecular Weight	307.364 g/mol
SMILES	O[C@]1(C(N2[C@@]1(SC([C@@]2(C(OCc1ccccc1)=O)[H])(C)C)[H])=O)[H]
SPLASH	splash10-0006-9020000000-760f5ad23b90908ffe61
Source of Spectrum	J-55-5116-24
Wiley ID	1308870