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4-Methyl-1-(p-tolylsulfanyl)-2-oxaspiro[4.14]nonadecan-3-one
SpectraBase Compound ID LaotnkGxS7r
InChI InChI=1S/C26H40O2S/c1-21-15-17-23(18-16-21)29-25-26(22(2)24(27)28-25)19-13-11-9-7-5-3-4-6-8-10-12-14-20-26/h15-18,22,25H,3-14,19-20H2,1-2H3
InChIKey QHJZYVJFWIIBOZ-UHFFFAOYSA-N
Mol Weight 416.7 g/mol
Molecular Formula C26H40O2S
Exact Mass 416.274902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8u90mYKdpIB
Name 4-Methyl-1-(p-tolylsulfanyl)-2-oxaspiro[4.14]nonadecan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O2S
InChI InChI=1S/C26H40O2S/c1-21-15-17-23(18-16-21)29-25-26(22(2)24(27)28-25)19-13-11-9-7-5-3-4-6-8-10-12-14-20-26/h15-18,22,25H,3-14,19-20H2,1-2H3
InChIKey QHJZYVJFWIIBOZ-UHFFFAOYSA-N
Molecular Weight 416.664 g/mol
SMILES C1(OC(=O)C(C11CCCCCCCCCCCCCC1)C)Sc1ccc(cc1)C
SPLASH splash10-0006-2090000000-fd1e241221be25f0059c
Source of Spectrum F-59-4335-25
Wiley ID 1678257