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(R)-4-allyl-2-((S)-2-(methoxymethyl)pyrrolidine-1-carbonyl)-4-(3-methylphenethyl)cyclohex-2-enone
SpectraBase Compound ID DGAml7qy5bE
InChI InChI=1S/C25H33NO3/c1-4-12-25(13-10-20-8-5-7-19(2)16-20)14-11-23(27)22(17-25)24(28)26-15-6-9-21(26)18-29-3/h4-5,7-8,16-17,21H,1,6,9-15,18H2,2-3H3/t21-,25+/m0/s1
InChIKey ISOAXYXKAGYTPB-SQJMNOBHSA-N
Mol Weight 395.5 g/mol
Molecular Formula C25H33NO3
Exact Mass 395.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9lQajeHG6hc
Name (R)-4-allyl-2-((S)-2-(methoxymethyl)pyrrolidine-1-carbonyl)-4-(3-methylphenethyl)cyclohex-2-enone
Alternate Name(s) (R)-4-allyl-2-((S)-2-(methoxymethyl)pyrrolidine-1-carbonyl)-4-(3-methylphenethyl)cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H33NO3
InChI InChI=1S/C25H33NO3/c1-4-12-25(13-10-20-8-5-7-19(2)16-20)14-11-23(27)22(17-25)24(28)26-15-6-9-21(26)18-29-3/h4-5,7-8,16-17,21H,1,6,9-15,18H2,2-3H3/t21-,25+/m0/s1
InChIKey ISOAXYXKAGYTPB-SQJMNOBHSA-N
Molecular Weight 395.543 g/mol
SMILES c1c(cccc1CC[C@]1(CC=C)CCC(=O)C(C(N2CCC[C@]2(COC)[H])=O)=C1)C
SPLASH splash10-0zgi-0669000000-9aede60686da799e575e
Source of Spectrum F5-13-2738-minor_10e
Wiley ID 1802137