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2S,5S,6R-2-((1-Methoxymethyl)cyclohexyl)-4,5-dimethyl-6-phenylmorpholin-3-one
SpectraBase Compound ID BFzVt3GNwYJ
InChI InChI=1S/C20H29NO3/c1-15-17(16-10-6-4-7-11-16)24-18(19(22)21(15)2)20(14-23-3)12-8-5-9-13-20/h4,6-7,10-11,15,17-18H,5,8-9,12-14H2,1-3H3/t15-,17-,18+/m0/s1
InChIKey JGDKAKCUPYNDHD-RYQLBKOJSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUflgjZcREH
Name 2S,5S,6R-2-((1-Methoxymethyl)cyclohexyl)-4,5-dimethyl-6-phenylmorpholin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-15-17(16-10-6-4-7-11-16)24-18(19(22)21(15)2)20(14-23-3)12-8-5-9-13-20/h4,6-7,10-11,15,17-18H,5,8-9,12-14H2,1-3H3/t15-,17-,18+/m0/s1
InChIKey JGDKAKCUPYNDHD-RYQLBKOJSA-N
Molecular Weight 331.456 g/mol
SMILES C1(N([C@]([C@](O[C@]1(C1(COC)CCCCC1)[H])(c1ccccc1)[H])(C)[H])C)=O
SPLASH splash10-0a4i-5290000000-72779076b55d04c459b1
Source of Spectrum F-59-3280-5a
Wiley ID 1677952