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N-Methoxymethyl-2-pyrrolemethyl p-tolylsulfone
SpectraBase Compound ID 3URuDAW4s1n
InChI InChI=1S/C14H17NO3S/c1-12-5-7-14(8-6-12)19(16,17)10-13-4-3-9-15(13)11-18-2/h3-9H,10-11H2,1-2H3
InChIKey RAKYXUBYCPITPQ-UHFFFAOYSA-N
Mol Weight 279.35 g/mol
Molecular Formula C14H17NO3S
Exact Mass 279.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jKut6lEBUC
Name N-Methoxymethyl-2-pyrrolemethyl p-tolylsulfone
Alternate Name(s) 1-(methoxymethyl)-2-{[(4-methylphenyl)sulfonyl]methyl}-1H-pyrrole [1-(methoxymethyl)-1H-pyrrol-2-yl]methyl 4-methylphenyl sulfone
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Formula C14H17NO3S
InChI InChI=1S/C14H17NO3S/c1-12-5-7-14(8-6-12)19(16,17)10-13-4-3-9-15(13)11-18-2/h3-9H,10-11H2,1-2H3
InChIKey RAKYXUBYCPITPQ-UHFFFAOYSA-N
Molecular Weight 279.354 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)c1[n](ccc1)COC
SPLASH splash10-00di-1940000000-177b2152f684048a257d
Source of Spectrum H1-38-501-13
Wiley ID 756036