(3R,3aR,9bS)-1-Methyl-8-nitro-3-phenyl-1,3,3a,9b-tetrahydro-2,5-dioxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide

SpectraBase Compound ID	3SiqQAb1H5O
InChI	InChI=1S/C16H14N2O6S/c1-17-14-12-9-11(18(19)20)7-8-13(12)24-25(21,22)16(14)15(23-17)10-5-3-2-4-6-10/h2-9,14-16H,1H3/t14-,15+,16+/m0/s1
InChIKey	IKIFLCISDZNHTO-ARFHVFGLSA-N Google Search
Mol Weight	362.36 g/mol
Molecular Formula	C16H14N2O6S
Exact Mass	362.057257 g/mol

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SpectraBase Spectrum ID	B1q4xOLcTi4
Name	(3R,3aR,9bS)-1-Methyl-8-nitro-3-phenyl-1,3,3a,9b-tetrahydro-2,5-dioxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H14N2O6S
InChI	InChI=1S/C16H14N2O6S/c1-17-14-12-9-11(18(19)20)7-8-13(12)24-25(21,22)16(14)15(23-17)10-5-3-2-4-6-10/h2-9,14-16H,1H3/t14-,15+,16+/m0/s1
InChIKey	IKIFLCISDZNHTO-ARFHVFGLSA-N
Molecular Weight	362.356 g/mol
SMILES	[C@@]12(S(Oc3ccc(cc3[C@@]2(N(C)O[C@@]1(c1ccccc1)[H])[H])N(=O)=O)(=O)=O)[H]
SPLASH	splash10-00kb-0901000000-4dd6e46f7867ffe4daaf
Source of Spectrum	F-68-3646-3d
Synonyms	1-Methyl-8-nitro-3-phenyl-1,3,3a,9b-tetrahydrobenzo[e][1,2]-oxathiino[4,3-c]isoxazole-4,4-dioxide
Wiley ID	1708530