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3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
SpectraBase Compound ID 2z1Eo9UjXfS
InChI InChI=1S/C23H29NO4/c1-14-4-3-7-23(2)10-21-16(9-18(14)23)17(22(25)28-21)12-24-11-15-5-6-19-20(8-15)27-13-26-19/h5-6,8,16-17,21,24H,3-4,7,9-13H2,1-2H3
InChIKey XSVXDDWVCLSCAX-UHFFFAOYSA-N
Mol Weight 383.49 g/mol
Molecular Formula C23H29NO4
Exact Mass 383.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32ojDldB6LC
Name 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29NO4
InChI InChI=1S/C23H29NO4/c1-14-4-3-7-23(2)10-21-16(9-18(14)23)17(22(25)28-21)12-24-11-15-5-6-19-20(8-15)27-13-26-19/h5-6,8,16-17,21,24H,3-4,7,9-13H2,1-2H3
InChIKey XSVXDDWVCLSCAX-UHFFFAOYSA-N
Molecular Weight 383.488 g/mol
SMILES N(CC1C(OC2CC3(CCCC(=C3CC12)C)C)=O)Cc1cc2OCOc2cc1
SPLASH splash10-0udr-3900000000-f0f4c06d8e43f3aea260
Source of Spectrum AD-0-2532-0
Synonyms 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-5,8a-dimethyl-3,3a,4,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-2-one 3H-Naphtho[2,3-b]furan-2-one, 3-[[(benzo[1,3]dioxol-5-ylmethyl)amino]methyl]-5,8a-dimethyl-3a,4,6,7,8,8a,9,9a-octahydro- 5,8a-dimethyl-3-[(piperonylamino)methyl]-3,3a,4,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Wiley ID 1436089