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Methyl (2S,3R,4S,5S)-4-(Benzo[d][1,3]dioxol-5-yl)-2-hydroxy-2-methyl-5-nitrotetrahydro-2H-pyran-3-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (2S,3R,4S,5S)-4-(Benzo[d][1,3]dioxol-5-yl)-2-hydroxy-2-methyl-5-nitrotetrahydro-2H-pyran-3-carboxylate
SpectraBase Compound ID 8AxECGEtnYO
InChI InChI=1S/C15H17NO8/c1-15(18)13(14(17)21-2)12(9(6-24-15)16(19)20)8-3-4-10-11(5-8)23-7-22-10/h3-5,9,12-13,18H,6-7H2,1-2H3/t9-,12+,13+,15+/m1/s1
InChIKey GHLWFWBRQBAMTN-IRIUXVKKSA-N
Mol Weight 339.3 g/mol
Molecular Formula C15H17NO8
Exact Mass 339.095417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pARkP4RwO
Name Methyl (2S,3R,4S,5S)-4-(Benzo[d][1,3]dioxol-5-yl)-2-hydroxy-2-methyl-5-nitrotetrahydro-2H-pyran-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO8
InChI InChI=1S/C15H17NO8/c1-15(18)13(14(17)21-2)12(9(6-24-15)16(19)20)8-3-4-10-11(5-8)23-7-22-10/h3-5,9,12-13,18H,6-7H2,1-2H3/t9-,12+,13+,15+/m1/s1
InChIKey GHLWFWBRQBAMTN-IRIUXVKKSA-N
Molecular Weight 339.300 g/mol
SMILES O[C@@]1([C@@]([C@]([C@](N(=O)=O)(CO1)[H])(c1cc2OCOc2cc1)[H])(C(=O)OC)[H])C
SPLASH splash10-0170-0595000000-42c360a4c0b8960dcc0e
Source of Spectrum F4-46-1266-3h
Synonyms (2S,3R,4S,5S)-methyl 4-(benzo[d][1,3]dioxol-5-yl)-2-hydroxy-2-methyl-5-nitrotetrahydro-2H-pyran-3-carboxylate
Wiley ID 1742031