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2,6-Dimethoxy-4-hydroxyphenethylisothiocyanate TMS
SpectraBase Compound ID 309mTOdpMFj
InChI InChI=1S/C14H21NO3SSi/c1-16-13-8-11(18-20(3,4)5)9-14(17-2)12(13)6-7-15-10-19/h8-9H,6-7H2,1-5H3
InChIKey NUEMLJGDTGELGD-UHFFFAOYSA-N
Mol Weight 311.47 g/mol
Molecular Formula C14H21NO3SSi
Exact Mass 311.101141 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGV7fI0WQCm
Name 2,6-Dimethoxy-4-hydroxyphenethylisothiocyanate TMS
Classification Phenethylamine designer drug derivative
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Exact Mass 311.101141246 u
Formula C14H21NO3SSi
InChI InChI=1S/C14H21NO3SSi/c1-16-13-8-11(18-20(3,4)5)9-14(17-2)12(13)6-7-15-10-19/h8-9H,6-7H2,1-5H3
InChIKey NUEMLJGDTGELGD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 311.471 g/mol
Nominal Mass 311 u
Quality 1000
Retention Index 2143
SMILES C1(=CC(=C(C(=C1)OC)CCN=C=S)OC)O[Si](C)(C)C
SPLASH splash10-000i-5490000000-e442348dfae8ac5488a2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4-(2-isothiocyanatoethyl)-3,5-dimethoxyphenoxy)(trimethyl)silane
Technique GC/MS
Wiley ID DD2024_018136