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3-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
SpectraBase Compound ID L3ye8ptb0T5
InChI InChI=1S/C20H29N3O2/c1-13-4-3-6-20(2)9-18-15(8-17(13)20)16(19(24)25-18)11-21-7-5-14-10-22-12-23-14/h10,12,15-18,21H,1,3-9,11H2,2H3,(H,22,23)
InChIKey LIPXWZPIPQPEAZ-UHFFFAOYSA-N
Mol Weight 343.47 g/mol
Molecular Formula C20H29N3O2
Exact Mass 343.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdsIp3f8w5n
Name 3-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
Alternate Name(s) 3-[[2-(1H-imidazol-5-yl)ethylamino]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one Decahydronaphtho[2,3-b]furan-2-one, 3-[[2-(1H-imidazol-4-yl)ethylamino]methyl]-8a-methyl-5-methylene-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29N3O2
InChI InChI=1S/C20H29N3O2/c1-13-4-3-6-20(2)9-18-15(8-17(13)20)16(19(24)25-18)11-21-7-5-14-10-22-12-23-14/h10,12,15-18,21H,1,3-9,11H2,2H3,(H,22,23)
InChIKey LIPXWZPIPQPEAZ-UHFFFAOYSA-N
Molecular Weight 343.471 g/mol
SMILES N(CC1C(OC2CC3(CCCC(C3CC12)=C)C)=O)CCc1c[nH]cn1
SPLASH splash10-001i-9300000000-8e9a7eda344ba40d7934
Wiley ID 1437678