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((S)-1-(4-chlorobutyl)-2,3-dimethylcyclohexa-2,5-dien-1-yl)((S)-2-(methoxymethyl)pyrrolidin-1-yl)methanone
SpectraBase Compound ID 3lFDvziySi4
InChI InChI=1S/C19H30ClNO2/c1-15-8-6-11-19(16(15)2,10-4-5-12-20)18(22)21-13-7-9-17(21)14-23-3/h6,11,17H,4-5,7-10,12-14H2,1-3H3/t17-,19-/m0/s1
InChIKey JGBWTKVYZTWYGW-HKUYNNGSSA-N
Mol Weight 339.91 g/mol
Molecular Formula C19H30ClNO2
Exact Mass 339.196507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fwtMRlcXsR
Name ((S)-1-(4-chlorobutyl)-2,3-dimethylcyclohexa-2,5-dien-1-yl)((S)-2-(methoxymethyl)pyrrolidin-1-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30ClNO2
InChI InChI=1S/C19H30ClNO2/c1-15-8-6-11-19(16(15)2,10-4-5-12-20)18(22)21-13-7-9-17(21)14-23-3/h6,11,17H,4-5,7-10,12-14H2,1-3H3/t17-,19-/m0/s1
InChIKey JGBWTKVYZTWYGW-HKUYNNGSSA-N
Literature Reference DOI 10.1021/ol8029017
Molecular Weight 339.907 g/mol
SMILES C1=CCC(=C([C@]1(C(N1CCC[C@]1(COC)[H])=O)CCCCCl)C)C
SPLASH splash10-006x-8900000000-459ca28cfde5b80edad0
Source of Spectrum A1-11-963/SMS9-10a
Wiley ID 1756598