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(3S,4R,5R)-2-methyl-3-(1-methyl-2-indolyl)isoxazolidine-4,5-dicarboxylic acid
SpectraBase Compound ID Gq3WvF0C7Bj
InChI InChI=1S/C15H16N2O5/c1-16-9-6-4-3-5-8(9)7-10(16)12-11(14(18)19)13(15(20)21)22-17(12)2/h3-7,11-13H,1-2H3,(H,18,19)(H,20,21)/t11-,12-,13-/m1/s1
InChIKey WXLXWWRTXCNYLU-JHJVBQTASA-N
Mol Weight 304.3 g/mol
Molecular Formula C15H16N2O5
Exact Mass 304.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LmAeE3gbN24
Name (3S,4R,5R)-2-methyl-3-(1-methyl-2-indolyl)isoxazolidine-4,5-dicarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16N2O5
InChI InChI=1S/C15H16N2O5/c1-16-9-6-4-3-5-8(9)7-10(16)12-11(14(18)19)13(15(20)21)22-17(12)2/h3-7,11-13H,1-2H3,(H,18,19)(H,20,21)/t11-,12-,13-/m1/s1
InChIKey WXLXWWRTXCNYLU-JHJVBQTASA-N
Molecular Weight 304.302 g/mol
SMILES OC([C@@]1(ON([C@@]([C@]1(C(=O)O)[H])(c1[n](c2ccccc2c1)C)[H])C)[H])=O
SPLASH splash10-0ab9-0900000000-f7e9b6e9fb434391dd98
Source of Spectrum KC-0-955-6
Synonyms (3S,4R,5R)-2-methyl-3-(1-methylindol-2-yl)-1,2-oxazolidine-4,5-dicarboxylic acid (3S,4R,5R)-2-methyl-3-(1-methylindol-2-yl)isoxazolidine-4,5-dicarboxylic acid
Wiley ID 787852