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(6RS)-N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-6-(4'-chloropheny)-2,3-didehydropiperidine
SpectraBase Compound ID 6e768Q3P7Tx
InChI InChI=1S/C25H25ClN2O3/c1-2-16-15-28(23(13-24(16)29)17-7-9-19(26)10-8-17)20(12-25(30)31)11-18-14-27-22-6-4-3-5-21(18)22/h3-10,14-15,20,23,27H,2,11-13H2,1H3,(H,30,31)/t20-,23+/m0/s1
InChIKey IPJIMOFZLJLJMJ-NZQKXSOJSA-N
Mol Weight 436.94 g/mol
Molecular Formula C25H25ClN2O3
Exact Mass 436.15537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55kbo6Ni16U
Name (6RS)-N-((S)-1-Carboxymethyl-2-[indol-3-yl]ethyl)-3-ethyl-4-oxo-6-(4'-chloropheny)-2,3-didehydropiperidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25ClN2O3
InChI InChI=1S/C25H25ClN2O3/c1-2-16-15-28(23(13-24(16)29)17-7-9-19(26)10-8-17)20(12-25(30)31)11-18-14-27-22-6-4-3-5-21(18)22/h3-10,14-15,20,23,27H,2,11-13H2,1H3,(H,30,31)/t20-,23+/m0/s1
InChIKey IPJIMOFZLJLJMJ-NZQKXSOJSA-N
Molecular Weight 436.939 g/mol
SMILES OC(C[C@](Cc1c[nH]c2c1cccc2)(N1C=C(CC)C(C[C@@]1(c1ccc(cc1)Cl)[H])=O)[H])=O
SPLASH splash10-001i-0900200000-230e1b6b4e77119d4368
Source of Spectrum QE-3-148-18
Wiley ID 843031