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Methyl (2S,3'R)-2-(2,3-dihydro-3-methoxy-1-oxo-1H-isoindol-2-yl)-4-methyl-pentanoate
SpectraBase Compound ID KQm7hS4P6IW
InChI InChI=1S/C16H21NO4/c1-10(2)9-13(16(19)21-4)17-14(18)11-7-5-6-8-12(11)15(17)20-3/h5-8,10,13,15H,9H2,1-4H3/t13-,15+/m0/s1
InChIKey MYBQISJXGUKOIN-DZGCQCFKSA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C5T5YEmqKMe
Name Methyl (2S,3'R)-2-(2,3-dihydro-3-methoxy-1-oxo-1H-isoindol-2-yl)-4-methyl-pentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.147058156 u
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-10(2)9-13(16(19)21-4)17-14(18)11-7-5-6-8-12(11)15(17)20-3/h5-8,10,13,15H,9H2,1-4H3/t13-,15+/m0/s1
InChIKey MYBQISJXGUKOIN-DZGCQCFKSA-N
Instrument Name AEI MS-30
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0002.706
Quality 59
SMILES [C@@]1(OC)(N(C(C2=CC=CC=C12)=O)[C@](C(=O)OC)(CC(C)C)[H])[H]
SPLASH splash10-001i-0980000000-7a24be8fd735280240cf
Source of Spectrum ARK-2001-72-40c (DOI: 10.3998/ark.5550190.0002.706)
Wiley ID 1908806