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2-(Phenylmethyl)-4-(phenylsulfonyl)butanal
SpectraBase Compound ID Gr6bbTs7l66
InChI InChI=1S/C17H18O3S/c18-14-16(13-15-7-3-1-4-8-15)11-12-21(19,20)17-9-5-2-6-10-17/h1-10,14,16H,11-13H2
InChIKey ONGAQTWWDXECCT-UHFFFAOYSA-N
Mol Weight 302.39 g/mol
Molecular Formula C17H18O3S
Exact Mass 302.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sbkTXt0U4
Name 2-(Phenylmethyl)-4-(phenylsulfonyl)butanal
Alternate Name(s) 2-Benzyl-4-besyl-butyraldehyde 4-(benzenesulfonyl)-2-(phenylmethyl)butanal 4-(benzenesulfonyl)-2-benzyl-butanal
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Formula C17H18O3S
InChI InChI=1S/C17H18O3S/c18-14-16(13-15-7-3-1-4-8-15)11-12-21(19,20)17-9-5-2-6-10-17/h1-10,14,16H,11-13H2
InChIKey ONGAQTWWDXECCT-UHFFFAOYSA-N
Molecular Weight 302.388 g/mol
SMILES C(C(CCS(=O)(=O)c1ccccc1)Cc1ccccc1)=O
SPLASH splash10-0udl-4930000000-e8b534cf22cba608b04e
Source of Spectrum K-2001-320-10
Wiley ID 1578566