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Pyrrolidine, 2-(methoxymethyl)-1-[[1-methyl-2-(phenylmethyl)cyclohexyl]carbonyl]-, [1S-[1.alpha.(R*),2.beta.]]-
SpectraBase Compound ID EXpUwKLMVEH
InChI InChI=1S/C21H31NO2/c1-21(20(23)22-14-8-12-19(22)16-24-2)13-7-6-11-18(21)15-17-9-4-3-5-10-17/h3-5,9-10,18-19H,6-8,11-16H2,1-2H3/t18-,19-,21-/m0/s1
InChIKey SISWDZWOWCRRFZ-ZJOUEHCJSA-N
Mol Weight 329.48 g/mol
Molecular Formula C21H31NO2
Exact Mass 329.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID z1eAMPDKrA
Name Pyrrolidine, 2-(methoxymethyl)-1-[[1-methyl-2-(phenylmethyl)cyclohexyl]carbonyl]-, [1S-[1.alpha.(R*),2.beta.]]-
Alternate Name(s) ((2S)-1-{[(1S,2S)-2-benzyl-1-methylcyclohexyl]carbonyl}pyrrolidinyl)methyl methyl ether (1S,2S,2'S)-2-benzyl-1-methyl-1-[[2'-(methoxymethyl)pyrrolidinyl]-carbonyl]cyclohexane (2S)-1-{[(1S,2S)-2-benzyl-1-methylcyclohexyl]carbonyl}-2-(methoxymethyl)pyrrolidine
CAS Registry Number 134389-49-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO2
InChI InChI=1S/C21H31NO2/c1-21(20(23)22-14-8-12-19(22)16-24-2)13-7-6-11-18(21)15-17-9-4-3-5-10-17/h3-5,9-10,18-19H,6-8,11-16H2,1-2H3/t18-,19-,21-/m0/s1
InChIKey SISWDZWOWCRRFZ-ZJOUEHCJSA-N
Molecular Weight 329.484 g/mol
SMILES C(N1[C@](COC)(CCC1)[H])([C@@]1([C@](Cc2ccccc2)(CCCC1)[H])C)=O
SPLASH splash10-001i-0109000000-5ff3f87b484690a9a7ae
Source of Spectrum C-113-4936-12
Wiley ID 1327279