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Neoclausenamidone (2-Benzyl-3-phenyl-4-hydroxy-1-methylpyrrolidin-5-one) isomer
SpectraBase Compound ID 3WkRAB4s71S
InChI InChI=1S/C18H17NO3/c1-19-15(16(20)13-10-6-3-7-11-13)14(17(21)18(19)22)12-8-4-2-5-9-12/h2-11,14-15,17,21H,1H3/t14?,15-,17+/m0/s1
InChIKey XBQHNXLCOAIENZ-IGGKNEPZSA-N
Mol Weight 295.34 g/mol
Molecular Formula C18H17NO3
Exact Mass 295.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKeTL2oGpbi
Name Neoclausenamidone (2-Benzyl-3-phenyl-4-hydroxy-1-methylpyrrolidin-5-one) isomer
Alternate Name(s) 5-Benzyl-4-phenyl-3-hydroxy-1-methylpyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO3
InChI InChI=1S/C18H17NO3/c1-19-15(16(20)13-10-6-3-7-11-13)14(17(21)18(19)22)12-8-4-2-5-9-12/h2-11,14-15,17,21H,1H3/t14?,15-,17+/m0/s1
InChIKey XBQHNXLCOAIENZ-IGGKNEPZSA-N
Molecular Weight 295.338 g/mol
SMILES O[C@]1(C(N([C@@](C1c1ccccc1)(C(=O)c1ccccc1)[H])C)=O)[H]
SPLASH splash10-0006-1900000000-8a3c346ba42a95ab56ee
Source of Spectrum KC-0-211-11
Wiley ID 784957