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1-(4-benzoxybut-1-ynylsulfonyl)-4-methyl-benzene
SpectraBase Compound ID 8eitPgpvata
InChI InChI=1S/C18H18O3S/c1-16-9-11-18(12-10-16)22(19,20)14-6-5-13-21-15-17-7-3-2-4-8-17/h2-4,7-12H,5,13,15H2,1H3
InChIKey WMRFUZDMHYAAAZ-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C18H18O3S
Exact Mass 314.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62qJcrfbIvk
Name 1-(4-benzoxybut-1-ynylsulfonyl)-4-methyl-benzene
Alternate Name(s) 1-(4-benzyloxybut-1-ynylsulfonyl)-4-methyl-benzene 1-Methyl-4-(4-phenylmethoxybut-1-ynylsulfonyl)benzene
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Formula C18H18O3S
InChI InChI=1S/C18H18O3S/c1-16-9-11-18(12-10-16)22(19,20)14-6-5-13-21-15-17-7-3-2-4-8-17/h2-4,7-12H,5,13,15H2,1H3
InChIKey WMRFUZDMHYAAAZ-UHFFFAOYSA-N
Molecular Weight 314.399 g/mol
SMILES C(#CCCOCc1ccccc1)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-9030000000-88dab63d1f95afd92ced
Source of Spectrum J-65-4549-1
Wiley ID 1532734