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(3aS,4R,7aS)-2-methyl-4-morpholino-6-vinyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
SpectraBase Compound ID 9p2jSw0VJrU
InChI InChI=1S/C15H20N2O3/c1-3-10-8-11-13(15(19)16(2)14(11)18)12(9-10)17-4-6-20-7-5-17/h3,9,11-13H,1,4-8H2,2H3/t11-,12+,13-/m0/s1
InChIKey GKJADLKXJZNVIY-XQQFMLRXSA-N
Mol Weight 276.34 g/mol
Molecular Formula C15H20N2O3
Exact Mass 276.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IQbnjyC9qE
Name (3aS,4R,7aS)-2-methyl-4-morpholino-6-vinyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20N2O3
InChI InChI=1S/C15H20N2O3/c1-3-10-8-11-13(15(19)16(2)14(11)18)12(9-10)17-4-6-20-7-5-17/h3,9,11-13H,1,4-8H2,2H3/t11-,12+,13-/m0/s1
InChIKey GKJADLKXJZNVIY-XQQFMLRXSA-N
Instrument Name Agilent HP 6890 series
Ionization Type EI
Literature Reference DOI 10.1002/anie.201510925
Molecular Weight 276.336 g/mol
Quality 85
Reported Formula C15H20N2O3
SMILES C=1[C@]([C@@]2([C@](CC1C=C)(C(N(C2=O)C)=O)[H])[H])(N1CCOCC1)[H]
SPLASH splash10-056r-4590000000-2caa51fdd7421b9e25d9
Source of Spectrum ACI-55-SM13-3a (DOI: 10.1002/anie.201510925)
Thin-Layer Chromatography 0.25 (petrol/EtOAc/Et3N, 60:40:1)
Wiley ID 1895396