9-Acetoxy-2-oxo-3-tosyl-2,3,3a,5a,6,9,9a,9boctahydronaphtho[2,1-d]oxazol

SpectraBase Compound ID	U2xvCvTFid
InChI	InChI=1S/C20H21NO6S/c1-12-6-9-15(10-7-12)28(24,25)21-16-11-8-14-4-3-5-17(26-13(2)22)18(14)19(16)27-20(21)23/h3,5-11,14,16-19H,4H2,1-2H3/t14-,16+,17+,18+,19+/m1/s1
InChIKey	XHZAULXOBJIHKM-RFZNHBKKSA-N Google Search
Mol Weight	403.45 g/mol
Molecular Formula	C20H21NO6S
Exact Mass	403.108959 g/mol

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SpectraBase Spectrum ID	L2INABSAwP5
Name	9-Acetoxy-2-oxo-3-tosyl-2,3,3a,5a,6,9,9a,9boctahydronaphtho[2,1-d]oxazol
Alternate Name(s)	Acetic acid (3aS,5aR,9S,9aS,9bR)-2-oxo-3-(toluene-4-sulfonyl)-2,3,3a,5a,6,9,9a,9b-octahydro-1-oxa-3-aza-cyclopenta[a]naphthalen-9-yl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H21NO6S
InChI	InChI=1S/C20H21NO6S/c1-12-6-9-15(10-7-12)28(24,25)21-16-11-8-14-4-3-5-17(26-13(2)22)18(14)19(16)27-20(21)23/h3,5-11,14,16-19H,4H2,1-2H3/t14-,16+,17+,18+,19+/m1/s1
InChIKey	XHZAULXOBJIHKM-RFZNHBKKSA-N
Molecular Weight	403.449 g/mol
SMILES	c1(S(N2C(O[C@]3([C@@]2(C=C[C@]2(CC=C[C@@]([C@@]32[H])(OC(=O)C)[H])[H])[H])[H])=O)(=O)=O)ccc(cc1)C
SPLASH	splash10-0159-3900000000-cd1289a02a62824f4583
Source of Spectrum	F-68-1891-12a
Wiley ID	1708249