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2-Tetrahydropyranyloxymethyl-1-(3-phenylthiopropynyl)benzene

View entire compound with spectra: 1 MS (GC)

2-Tetrahydropyranyloxymethyl-1-(3-phenylthiopropynyl)benzene
SpectraBase Compound ID EifiqWzVu99
InChI InChI=1S/C21H22O2S/c1-2-12-20(13-3-1)24-16-8-11-18-9-4-5-10-19(18)17-23-21-14-6-7-15-22-21/h1-5,9-10,12-13,21H,6-7,14-17H2
InChIKey YRROZQWGBLQDBL-UHFFFAOYSA-N
Mol Weight 338.47 g/mol
Molecular Formula C21H22O2S
Exact Mass 338.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GN3tsQnEGvR
Name 2-Tetrahydropyranyloxymethyl-1-(3-phenylthiopropynyl)benzene
Alternate Name(s) 2-({2-[3-(phenylsulfanyl)-1-propynyl]benzyl}oxy)tetrahydro-2H-pyran 2-[3-(phenylsulfanyl)-1-propynyl]benzyl tetrahydro-2H-pyran-2-yl ether
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O2S
InChI InChI=1S/C21H22O2S/c1-2-12-20(13-3-1)24-16-8-11-18-9-4-5-10-19(18)17-23-21-14-6-7-15-22-21/h1-5,9-10,12-13,21H,6-7,14-17H2
InChIKey YRROZQWGBLQDBL-UHFFFAOYSA-N
Molecular Weight 338.465 g/mol
SMILES C(#CCSc1ccccc1)c1c(COC2OCCCC2)cccc1
SPLASH splash10-000i-0090000000-1583f3e5e61e23525085
Source of Spectrum QA-45-786-17
Wiley ID 863016