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trans-2,3,3a,4,5,6,7,7a-Octahydro-1-oxo-3-(p-tolyl)-1H-isoindole
SpectraBase Compound ID G3IXZT9oeC
InChI InChI=1S/C15H19NO/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(17)16-14/h6-9,12-14H,2-5H2,1H3,(H,16,17)/t12-,13-,14-/m1/s1
InChIKey ZXVBOIDGHOOPEN-MGPQQGTHSA-N
Mol Weight 229.32 g/mol
Molecular Formula C15H19NO
Exact Mass 229.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMaD1BQVBVY
Name trans-2,3,3a,4,5,6,7,7a-Octahydro-1-oxo-3-(p-tolyl)-1H-isoindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO
InChI InChI=1S/C15H19NO/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(17)16-14/h6-9,12-14H,2-5H2,1H3,(H,16,17)/t12-,13-,14-/m1/s1
InChIKey ZXVBOIDGHOOPEN-MGPQQGTHSA-N
Molecular Weight 229.323 g/mol
SMILES N1[C@@]([C@@]2(CCCC[C@]2(C1=O)[H])[H])(c1ccc(cc1)C)[H]
SPLASH splash10-00fr-0890000000-472605e7125387d734ea
Source of Spectrum H1-36-1819-4
Synonyms (3S,3aR)-3-(4-methylphenyl)octahydro-1H-isoindol-1-one
Wiley ID 755264