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(2S*)-1,2-[(S*)-1-(3,4-Dimethyl-3-pentenyl)-1-(hydroxymethyl)methylene]-5-ethoxycarbonylindoline
SpectraBase Compound ID 6uIOhzLJtxA
InChI InChI=1S/C20H27NO3/c1-5-24-19(23)15-6-7-17-16(10-15)11-18-20(12-22,21(17)18)9-8-14(4)13(2)3/h6-7,10,18,22H,5,8-9,11-12H2,1-4H3/t18-,20-,21?/m0/s1
InChIKey ABESXOUCXJFZFX-WZENJKSDSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYOwxiLvEgO
Name (2S*)-1,2-[(S*)-1-(3,4-Dimethyl-3-pentenyl)-1-(hydroxymethyl)methylene]-5-ethoxycarbonylindoline
Alternate Name(s) Ethyl 1-(3,4-dimethyl-3-pentenyl)-1-(hydroxymethyl)-7,7a-dihydro-1H-azirino[1,2-a]indole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-5-24-19(23)15-6-7-17-16(10-15)11-18-20(12-22,21(17)18)9-8-14(4)13(2)3/h6-7,10,18,22H,5,8-9,11-12H2,1-4H3/t18-,20-,21?/m0/s1
InChIKey ABESXOUCXJFZFX-WZENJKSDSA-N
Molecular Weight 329.440 g/mol
SMILES OC[C@@]1(N2[C@]1(Cc1c2ccc(C(=O)OCC)c1)[H])CCC(=C(C)C)C
SPLASH splash10-00kg-2953000000-e4ce0e72df368d49507f
Source of Spectrum F-52-10625-37
Wiley ID 798185