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(-)-(3S,4S)-3-[[2(S)-[(methoxymethoxy)methyl]pyrrolidinyl]carbonyl]-3-methyl-4-phenylcyclohex-1-ene
SpectraBase Compound ID 3CQmGBLSamq
InChI InChI=1S/C21H29NO3/c1-21(13-7-6-12-19(21)17-9-4-3-5-10-17)20(23)22-14-8-11-18(22)15-25-16-24-2/h3-5,7,9-10,13,18-19H,6,8,11-12,14-16H2,1-2H3/t18-,19-,21-/m0/s1
InChIKey PMUMHRVUQAMXFK-ZJOUEHCJSA-N
Mol Weight 343.47 g/mol
Molecular Formula C21H29NO3
Exact Mass 343.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1Iz3W97cVa
Name (-)-(3S,4S)-3-[[2(S)-[(methoxymethoxy)methyl]pyrrolidinyl]carbonyl]-3-methyl-4-phenylcyclohex-1-ene
Alternate Name(s) (2S)-2-[(methoxymethoxy)methyl]-1-{[(1S,6S)-1-methyl-6-phenyl-2-cyclohexen-1-yl]carbonyl}pyrrolidine
CAS Registry Number 113133-27-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO3
InChI InChI=1S/C21H29NO3/c1-21(13-7-6-12-19(21)17-9-4-3-5-10-17)20(23)22-14-8-11-18(22)15-25-16-24-2/h3-5,7,9-10,13,18-19H,6,8,11-12,14-16H2,1-2H3/t18-,19-,21-/m0/s1
InChIKey PMUMHRVUQAMXFK-ZJOUEHCJSA-N
Molecular Weight 343.467 g/mol
SMILES C([C@@]1([C@](c2ccccc2)(CCC=C1)[H])C)(N1[C@](COCOC)(CCC1)[H])=O
SPLASH splash10-006x-4900000000-7fb415044189dbf218d1
Source of Spectrum J-53-2462-2
Wiley ID 1337407