(1S)-(1.alpha.,2.alpha.,8.beta.,8a.beta.)-1-acetoxy-2,8-bis[(2,2-dimethylpropanoyl)oxy]hexahydro-3(2H)-indolizinone

SpectraBase Compound ID	FqbTSjABMoP
InChI	InChI=1S/C20H31NO7/c1-11(22)26-14-13-12(27-17(24)19(2,3)4)9-8-10-21(13)16(23)15(14)28-18(25)20(5,6)7/h12-15H,8-10H2,1-7H3/t12-,13-,14+,15+/m1/s1
InChIKey	XDRPCCQOLKLDIL-KBXIAJHMSA-N Google Search
Mol Weight	397.47 g/mol
Molecular Formula	C20H31NO7
Exact Mass	397.210052 g/mol

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SpectraBase Spectrum ID	7Jl4N9KwEc1
Name	(1S)-(1.alpha.,2.alpha.,8.beta.,8a.beta.)-1-acetoxy-2,8-bis[(2,2-dimethylpropanoyl)oxy]hexahydro-3(2H)-indolizinone
Alternate Name(s)	(1S,2S,8R,8aR)-1-(acetyloxy)-2-[(2,2-dimethylpropanoyl)oxy]-3-oxooctahydro-8-indolizinyl pivalate
CAS Registry Number	117270-02-7
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H31NO7
InChI	InChI=1S/C20H31NO7/c1-11(22)26-14-13-12(27-17(24)19(2,3)4)9-8-10-21(13)16(23)15(14)28-18(25)20(5,6)7/h12-15H,8-10H2,1-7H3/t12-,13-,14+,15+/m1/s1
InChIKey	XDRPCCQOLKLDIL-KBXIAJHMSA-N
Molecular Weight	397.468 g/mol
SMILES	[C@@]1(C(N2CCC[C@]([C@@]2([C@@]1(OC(=O)C)[H])[H])(OC(C(C)(C)C)=O)[H])=O)(OC(C(C)(C)C)=O)[H]
SPLASH	splash10-0zfu-6900000000-0f408cac652e7e635a88
Source of Spectrum	J-53-6029-29
Wiley ID	1367921