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1-(2-Allyloxy-1-phenylethyl)-2-[1-(phenylsulfonyl)-3-indolyl]-4-methylenepiperidine
SpectraBase Compound ID 3Ao0ptka1oa
InChI InChI=1S/C31H32N2O3S/c1-3-20-36-23-31(25-12-6-4-7-13-25)32-19-18-24(2)28(21-32)29-22-33(30-17-11-10-16-27(29)30)37(34,35)26-14-8-5-9-15-26/h3-17,22,28,31H,1-2,18-21,23H2/t28-,31+/m1/s1
InChIKey BQBSZCMTIUBSLE-MVSFAKPFSA-N
Mol Weight 512.7 g/mol
Molecular Formula C31H32N2O3S
Exact Mass 512.213364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6z4UTwscbTd
Name 1-(2-Allyloxy-1-phenylethyl)-2-[1-(phenylsulfonyl)-3-indolyl]-4-methylenepiperidine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H32N2O3S
InChI InChI=1S/C31H32N2O3S/c1-3-20-36-23-31(25-12-6-4-7-13-25)32-19-18-24(2)28(21-32)29-22-33(30-17-11-10-16-27(29)30)37(34,35)26-14-8-5-9-15-26/h3-17,22,28,31H,1-2,18-21,23H2/t28-,31+/m1/s1
InChIKey BQBSZCMTIUBSLE-MVSFAKPFSA-N
Molecular Weight 512.668 g/mol
SMILES c1(S([n]2cc([C@@]3(CN([C@](c4ccccc4)(COCC=C)[H])CCC3=C)[H])c3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-0006-0013900000-675bb909a3e83c4f4115
Source of Spectrum F-51-7540-35
Synonyms 3-[(R)-1-((R)-2-Allyloxy-1-phenyl-ethyl)-4-methylene-piperidin-3-yl]-1-benzenesulfonyl-1H-indole 3-{1-[2-(allyloxy)-1-phenylethyl]-4-methylene-2-piperidinyl}-1-(phenylsulfonyl)-1H-indole Allyl 2-{4-methylene-2-[1-(phenylsulfonyl)-1H-indol-3-yl]-1-piperidinyl}-2-phenylethyl ether
Wiley ID 792479