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5,8a-dimethyl-3-[(3-pyridinylmethylamino)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
SpectraBase Compound ID 1eQxFjproKX
InChI InChI=1S/C21H28N2O2/c1-14-5-3-7-21(2)10-19-16(9-18(14)21)17(20(24)25-19)13-23-12-15-6-4-8-22-11-15/h4,6,8-9,11,14,16-17,19,23H,3,5,7,10,12-13H2,1-2H3
InChIKey ZQCAWWOBCZAYGY-UHFFFAOYSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFHrYiS0TDY
Name 5,8a-dimethyl-3-[(3-pyridinylmethylamino)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-14-5-3-7-21(2)10-19-16(9-18(14)21)17(20(24)25-19)13-23-12-15-6-4-8-22-11-15/h4,6,8-9,11,14,16-17,19,23H,3,5,7,10,12-13H2,1-2H3
InChIKey ZQCAWWOBCZAYGY-UHFFFAOYSA-N
Molecular Weight 340.467 g/mol
SMILES N(CC1C2C=C3C(CCCC3(CC2OC1=O)C)C)Cc1cnccc1
SPLASH splash10-0a4l-3900000000-6137cad39a82779b0183
Synonyms 5,8a-dimethyl-3-[(3-pyridylmethylamino)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one 5,8a-dimethyl-3-[(pyridin-3-ylmethylamino)methyl]-3,3a,5,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one
Wiley ID 1437622