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3-[(3-Imidazol-1-yl-propylamino)-methyl]-8a-methyl-5-methylene-decahydro-naphtho[2,3-b]furan-2-one
SpectraBase Compound ID GFgPt3Qmp6P
InChI InChI=1S/C21H31N3O2/c1-15-5-3-6-21(2)12-19-16(11-18(15)21)17(20(25)26-19)13-22-7-4-9-24-10-8-23-14-24/h8,10,14,16-19,22H,1,3-7,9,11-13H2,2H3
InChIKey GVQXMWUKRNTWTN-UHFFFAOYSA-N
Mol Weight 357.5 g/mol
Molecular Formula C21H31N3O2
Exact Mass 357.241627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4P9roTCtSkJ
Name 3-[(3-Imidazol-1-yl-propylamino)-methyl]-8a-methyl-5-methylene-decahydro-naphtho[2,3-b]furan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N3O2
InChI InChI=1S/C21H31N3O2/c1-15-5-3-6-21(2)12-19-16(11-18(15)21)17(20(25)26-19)13-22-7-4-9-24-10-8-23-14-24/h8,10,14,16-19,22H,1,3-7,9,11-13H2,2H3
InChIKey GVQXMWUKRNTWTN-UHFFFAOYSA-N
Molecular Weight 357.498 g/mol
SMILES N(CC1C(OC2CC3(CCCC(C3CC12)=C)C)=O)CCC[n]1cncc1
SPLASH splash10-001a-9800000000-da38f009056c452c1b7a
Synonyms 3-[(3-imidazol-1-ylpropylamino)methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one 3-[(3-imidazol-1-ylpropylamino)methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one 3-[[3-(1-imidazolyl)propylamino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
Wiley ID 1437615