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RCS-8 3-methoxy isomer

View entire compound with spectra: 3 FTIR, 1 Raman, and 1 MS (GC)

RCS-8 3-methoxy isomer
SpectraBase Compound ID 9e11dvRoD3B
InChI InChI=1S/C25H29NO2/c1-28-21-11-7-10-20(16-21)17-25(27)23-18-26(24-13-6-5-12-22(23)24)15-14-19-8-3-2-4-9-19/h5-7,10-13,16,18-19H,2-4,8-9,14-15,17H2,1H3
InChIKey RPDBGECJZVHHKG-UHFFFAOYSA-N
Mol Weight 375.51 g/mol
Molecular Formula C25H29NO2
Exact Mass 375.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 287lx48vfvs
Name RCS-8 3-methoxy isomer
Alternate Name(s) 1-(1-(2-cyclohexylethyl)-1H-indol-3-yl)-2-(3-methoxyphenyl)ethanone 1-(1-(2-cyclohexylethyl)-1H-indol-3-yl)-2-(3-methoxyphenyl)ethan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29NO2
InChI InChI=1S/C25H29NO2/c1-28-21-11-7-10-20(16-21)17-25(27)23-18-26(24-13-6-5-12-22(23)24)15-14-19-8-3-2-4-9-19/h5-7,10-13,16,18-19H,2-4,8-9,14-15,17H2,1H3
InChIKey RPDBGECJZVHHKG-UHFFFAOYSA-N
Molecular Weight 375.512 g/mol
SMILES C(Cc1cc(ccc1)OC)(c1c[n](c2ccccc12)CCC1CCCCC1)=O
SPLASH splash10-0udi-2390000000-6135e6e91d8fd30a0dbd
Source of Spectrum SWG-33-2575-0
Wiley ID 1809720