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3-(3-(2-Tetrahydropyranyl)oxypropyl)-2-(3-phenylthiopropynyl)naphthylene

View entire compound with spectra: 1 MS (GC)

3-(3-(2-Tetrahydropyranyl)oxypropyl)-2-(3-phenylthiopropynyl)naphthylene
SpectraBase Compound ID FwbVfvEipDU
InChI InChI=1S/C27H28O2S/c1-2-12-27(13-3-1)30-19-7-11-25-21-23-9-5-4-8-22(23)20-24(25)10-6-16-29-26-14-17-28-18-15-26/h1-5,8-9,12-13,20-21,26H,6,10,14-19H2
InChIKey VUEHIEMCHANUJY-UHFFFAOYSA-N
Mol Weight 416.58 g/mol
Molecular Formula C27H28O2S
Exact Mass 416.181001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMqOFSmGsot
Name 3-(3-(2-Tetrahydropyranyl)oxypropyl)-2-(3-phenylthiopropynyl)naphthylene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28O2S
InChI InChI=1S/C27H28O2S/c1-2-12-27(13-3-1)30-19-7-11-25-21-23-9-5-4-8-22(23)20-24(25)10-6-16-29-26-14-17-28-18-15-26/h1-5,8-9,12-13,20-21,26H,6,10,14-19H2
InChIKey VUEHIEMCHANUJY-UHFFFAOYSA-N
Molecular Weight 416.579 g/mol
SMILES C(c1c(cc2c(c1)cccc2)CCCOC1CCOCC1)#CCSc1ccccc1
SPLASH splash10-0a4i-0092100000-62d378643d40c446e712
Source of Spectrum QA-45-785-12
Wiley ID 863019