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(4S)-4-[(S)-[4-benzoxy-6-(1,3-dioxan-2-yl)-1H-indol-2-yl]-hydroxy-methyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID CQerT0v1yUN
InChI InChI=1S/C30H38N2O7/c1-29(2,3)39-28(34)32-24(18-38-30(32,4)5)26(33)23-16-21-22(31-23)14-20(27-35-12-9-13-36-27)15-25(21)37-17-19-10-7-6-8-11-19/h6-8,10-11,14-16,24,26-27,31,33H,9,12-13,17-18H2,1-5H3/t24-,26+/m0/s1
InChIKey WPBFXZBHXVGAIN-AZGAKELHSA-N
Mol Weight 538.6 g/mol
Molecular Formula C30H38N2O7
Exact Mass 538.267902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33APojf492N
Name (4S)-4-[(S)-[4-benzoxy-6-(1,3-dioxan-2-yl)-1H-indol-2-yl]-hydroxy-methyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester
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Formula C30H38N2O7
InChI InChI=1S/C30H38N2O7/c1-29(2,3)39-28(34)32-24(18-38-30(32,4)5)26(33)23-16-21-22(31-23)14-20(27-35-12-9-13-36-27)15-25(21)37-17-19-10-7-6-8-11-19/h6-8,10-11,14-16,24,26-27,31,33H,9,12-13,17-18H2,1-5H3/t24-,26+/m0/s1
InChIKey WPBFXZBHXVGAIN-AZGAKELHSA-N
Molecular Weight 538.641 g/mol
SMILES [nH]1c2cc(cc(c2cc1[C@]([C@]1(N(C(OC1)(C)C)C(=O)OC(C)(C)C)[H])(O)[H])OCc1ccccc1)C1OCCCO1
SPLASH splash10-0a4l-9310000000-639e979edccd59dd991b
Source of Spectrum E1-43-45-27
Synonyms (4S)-4-[(S)-[6-(1,3-dioxan-2-yl)-4-phenylmethoxy-1H-indol-2-yl]-hydroxymethyl]-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester tert-Butyl (4S)-4-[(S)-[4-benzyloxy-6-(1,3-dioxan-2-yl)-1H-indol-2-yl]-hydroxy-methyl]-2,2-dimethyl-oxazolidine-3-carboxylate tert-Butyl (4S)-4-[(S)-[6-(1,3-dioxan-2-yl)-4-phenylmethoxy-1H-indol-2-yl]-hydroxymethyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate tert-Butyl (4S)-4-[(S)-[6-(1,3-dioxan-2-yl)-4-phenylmethoxy-1H-indol-2-yl]-oxidanyl-methyl]-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
Wiley ID 1552845