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(3S,6R)-3-(1H-indol-3-ylmethyl)-6-phenylpiperazine-2,5-dione
SpectraBase Compound ID JWkOx1J9qMi
InChI InChI=1S/C19H17N3O2/c23-18-16(10-13-11-20-15-9-5-4-8-14(13)15)21-19(24)17(22-18)12-6-2-1-3-7-12/h1-9,11,16-17,20H,10H2,(H,21,24)(H,22,23)/t16-,17+/m0/s1
InChIKey ZGILKHMGZFULJT-DLBZAZTESA-N
Mol Weight 319.36 g/mol
Molecular Formula C19H17N3O2
Exact Mass 319.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DMM5ekGnIZ
Name (3S,6R)-3-(1H-indol-3-ylmethyl)-6-phenylpiperazine-2,5-dione
Alternate Name(s) (3S,6R)-3-(1H-indol-3-ylmethyl)-6-phenyl-piperazine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3O2
InChI InChI=1S/C19H17N3O2/c23-18-16(10-13-11-20-15-9-5-4-8-14(13)15)21-19(24)17(22-18)12-6-2-1-3-7-12/h1-9,11,16-17,20H,10H2,(H,21,24)(H,22,23)/t16-,17+/m0/s1
InChIKey ZGILKHMGZFULJT-DLBZAZTESA-N
Molecular Weight 319.364 g/mol
SMILES N1[C@@](C(N[C@](C1=O)(Cc1c[nH]c2c1cccc2)[H])=O)(c1ccccc1)[H]
SPLASH splash10-0002-9301000000-e6ac0f1d5abb3a65e542
Source of Spectrum KD-14-3128-5
Wiley ID 1636467