3-[[4-(3-methoxyphenyl)-3-methyl-1-piperazinyl]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one

SpectraBase Compound ID	6I7PHX0meTL
InChI	InChI=1S/C27H38N2O3/c1-18-7-6-10-27(3)15-25-22(14-24(18)27)23(26(30)32-25)17-28-11-12-29(19(2)16-28)20-8-5-9-21(13-20)31-4/h5,8-9,13,19,22-25H,1,6-7,10-12,14-17H2,2-4H3/t19-,22?,23?,24?,25?,27?/m0/s1
InChIKey	QJALQDMFCVLXKM-SIOOYEAMSA-N Google Search
Mol Weight	438.6 g/mol
Molecular Formula	C27H38N2O3
Exact Mass	438.288243 g/mol

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SpectraBase Spectrum ID	5WLmEmN86Gx
Name	3-[[4-(3-methoxyphenyl)-3-methyl-1-piperazinyl]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H38N2O3
InChI	InChI=1S/C27H38N2O3/c1-18-7-6-10-27(3)15-25-22(14-24(18)27)23(26(30)32-25)17-28-11-12-29(19(2)16-28)20-8-5-9-21(13-20)31-4/h5,8-9,13,19,22-25H,1,6-7,10-12,14-17H2,2-4H3/t19-,22?,23?,24?,25?,27?/m0/s1
InChIKey	QJALQDMFCVLXKM-SIOOYEAMSA-N
Molecular Weight	438.612 g/mol
SMILES	C1(C(OC2C1CC1C(CCCC1=C)(C)C2)=O)CN1C[C@](C)(N(CC1)c1cc(OC)ccc1)[H]
SPLASH	splash10-01p9-5930300000-8a113a44b3e39652ea53
Synonyms	3-[[4-(3-methoxyphenyl)-3-methyl-piperazin-1-yl]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one 3-[[4-(3-methoxyphenyl)-3-methyl-piperazin-1-yl]methyl]-8a-methyl-5-methylidene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f][1]benzofuran-2-one 3-[[4-(3-methoxyphenyl)-3-methyl-piperazino]methyl]-8a-methyl-5-methylene-3a,4,4a,6,7,8,9,9a-octahydro-3H-benzo[f]benzofuran-2-one
Wiley ID	1457770