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(3aS,9bS)-3a,4,5,9b-Tetrahydro-7-methoxy-3a-methylbenz[e]isoindolin-3-one
SpectraBase Compound ID 8NnxqPOD2dD
InChI InChI=1S/C14H17NO2/c1-14-6-5-9-7-10(17-2)3-4-11(9)12(14)8-15-13(14)16/h3-4,7,12H,5-6,8H2,1-2H3,(H,15,16)/t12-,14-/m0/s1
InChIKey VZAHTLULLSUCPY-JSGCOSHPSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IFlxt0qlLDR
Name (3aS,9bS)-3a,4,5,9b-Tetrahydro-7-methoxy-3a-methylbenz[e]isoindolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-14-6-5-9-7-10(17-2)3-4-11(9)12(14)8-15-13(14)16/h3-4,7,12H,5-6,8H2,1-2H3,(H,15,16)/t12-,14-/m0/s1
InChIKey VZAHTLULLSUCPY-JSGCOSHPSA-N
Molecular Weight 231.295 g/mol
SMILES N1C[C@@]2([C@@](C1=O)(CCc1c2ccc(c1)OC)C)[H]
SPLASH splash10-0089-0950000000-19709f588a85824f941e
Source of Spectrum Y1-34-486-5
Synonyms (3aS,9bS)-7-methoxy-3a-methyl-1,2,3a,4,5,9b-hexahydro-3H-benzo[e]isoindol-3-one 3a,4,5,9b-Tetrahydro-7-methoxy-3a-methylbenz[e]isoindolin-3-one
Wiley ID 1526500