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(5aR,8R,10aR,10bR)-8-Methoxycarbonyldecahydrooxepino[3,4-d]isoxazol[b-1,2]ipyrrolo-1-one
SpectraBase Compound ID 16tVAQ0WAR
InChI InChI=1S/C12H17NO5/c1-16-11(14)8-5-4-7-10-9(18-13(7)8)3-2-6-17-12(10)15/h7-10H,2-6H2,1H3/t7-,8-,9-,10-/m1/s1
InChIKey XRLLVUFOWGNNER-ZYUZMQFOSA-N
Mol Weight 255.27 g/mol
Molecular Formula C12H17NO5
Exact Mass 255.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AmMjdS326hO
Name (5aR,8R,10aR,10bR)-8-Methoxycarbonyldecahydrooxepino[3,4-d]isoxazol[b-1,2]ipyrrolo-1-one
Alternate Name(s) (5aR,8R,10aR,10bR)-8-Methoxycarbonyldecahydrooxepino[3,4-d]pyrrolo[1,2-b]isoxazol-1-one (5aRS,8RS,10aRS,10bRS)-8-Methoxycarbonyldecahydrooxepino[3,4-d]pyrrolo[1,2-b]isoxazol-1-one Methyl (5aR,8R,10aR,10bR)-1-oxodecahydrooxepino[3,4-d]pyrrolo[1,2-b]isoxazole-8-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO5
InChI InChI=1S/C12H17NO5/c1-16-11(14)8-5-4-7-10-9(18-13(7)8)3-2-6-17-12(10)15/h7-10H,2-6H2,1H3/t7-,8-,9-,10-/m1/s1
InChIKey XRLLVUFOWGNNER-ZYUZMQFOSA-N
Molecular Weight 255.270 g/mol
SMILES [C@]12(N(O[C@@]3(CCCOC([C@]23[H])=O)[H])[C@](CC1)(C(=O)OC)[H])[H]
SPLASH splash10-0002-2900000000-963a6279dc862152ca12
Source of Spectrum F-53-16815-23
Wiley ID 804796