(3S,3aS,9bS)-8-Bromo-1-methyl-3-phenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide

SpectraBase Compound ID	1ilt2DCSSAU
InChI	InChI=1S/C17H16BrNO3S/c1-19-10-14(11-5-3-2-4-6-11)17-16(19)13-9-12(18)7-8-15(13)22-23(17,20)21/h2-9,14,16-17H,10H2,1H3/t14-,16+,17+/m1/s1
InChIKey	PCOJSVSEKATGRJ-PVAVHDDUSA-N Google Search
Mol Weight	394.28 g/mol
Molecular Formula	C17H16BrNO3S
Exact Mass	393.003428 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	dFGkJqkGO
Name	(3S,3aS,9bS)-8-Bromo-1-methyl-3-phenyl-2,3,3a,9b-tetrahydro-1H-5-oxa-4-thia-1-aza-cyclopenta[a]naphthalene 4,4-dioxide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H16BrNO3S
InChI	InChI=1S/C17H16BrNO3S/c1-19-10-14(11-5-3-2-4-6-11)17-16(19)13-9-12(18)7-8-15(13)22-23(17,20)21/h2-9,14,16-17H,10H2,1H3/t14-,16+,17+/m1/s1
InChIKey	PCOJSVSEKATGRJ-PVAVHDDUSA-N
Molecular Weight	394.283 g/mol
SMILES	[C@@]12(S(Oc3ccc(cc3[C@@]2(N(C)C[C@@]1(c1ccccc1)[H])[H])Br)(=O)=O)[H]
SPLASH	splash10-000i-0093000000-b108a835d1ba4a52e13c
Source of Spectrum	F-68-3646-4e
Synonyms	8-Bromo-1-methyl-3-phenyl-1,2,3,3a,4,9b-hexahydrobenzo[e][1,2]oxathiino[4,3-b]pyrrole-4,4-dioxide
Wiley ID	1708521