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(E)-3-(4-(methylthio)benzylidene)-[1,1'-bi(cyclopentan)]-2-one
SpectraBase Compound ID 33CWDUZgBeW
InChI InChI=1S/C18H22OS/c1-20-16-9-6-13(7-10-16)12-15-8-11-17(18(15)19)14-4-2-3-5-14/h6-7,9-10,12,14,17H,2-5,8,11H2,1H3/b15-12+
InChIKey GLBIHCXXCXGIRI-NTCAYCPXSA-N
Mol Weight 286.43 g/mol
Molecular Formula C18H22OS
Exact Mass 286.139137 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F0lXMddzY76
Name (E)-3-(4-(methylthio)benzylidene)-[1,1'-bi(cyclopentan)]-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.139136501 u
Formula C18H22OS
InChI InChI=1S/C18H22OS/c1-20-16-9-6-13(7-10-16)12-15-8-11-17(18(15)19)14-4-2-3-5-14/h6-7,9-10,12,14,17H,2-5,8,11H2,1H3/b15-12+
InChIKey GLBIHCXXCXGIRI-NTCAYCPXSA-N
Molecular Weight 286.433 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4372
Solvent DMSO-d6
Source Vendor ID: NMR/12309226