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[3-(mercaptomethyl)-4-methoxy-1-naphthalenyl]methanethiol
SpectraBase Compound ID 5STxnvXtYWl
InChI InChI=1S/C13H14OS2/c1-14-13-10(8-16)6-9(7-15)11-4-2-3-5-12(11)13/h2-6,15-16H,7-8H2,1H3
InChIKey IVUGFLOUTIVSAG-UHFFFAOYSA-N
Mol Weight 250.37 g/mol
Molecular Formula C13H14OS2
Exact Mass 250.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C72BAaPBVUO
Name [3-(mercaptomethyl)-4-methoxy-1-naphthalenyl]methanethiol
Alternate Name(s) [3-(mercaptomethyl)-4-methoxy-1-naphthyl]methanethiol [4-methoxy-3-(sulfanylmethyl)-1-naphthyl]methanethiol [4-methoxy-3-(sulfanylmethyl)naphthalen-1-yl]methanethiol
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Formula C13H14OS2
InChI InChI=1S/C13H14OS2/c1-14-13-10(8-16)6-9(7-15)11-4-2-3-5-12(11)13/h2-6,15-16H,7-8H2,1H3
InChIKey IVUGFLOUTIVSAG-UHFFFAOYSA-N
Molecular Weight 250.374 g/mol
SMILES SCc1c2c(c(c(CS)c1)OC)cccc2
SPLASH splash10-014i-1490000000-5f107e328125ef06062d
Source of Spectrum J-62-6484-40
Wiley ID 1253046