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1,2,2-tris(p-methoxyphenyl)ethenyl thiocyanate
SpectraBase Compound ID 3PB45pkfjBf
InChI InChI=1S/C24H21NO3S/c1-26-20-10-4-17(5-11-20)23(18-6-12-21(27-2)13-7-18)24(29-16-25)19-8-14-22(28-3)15-9-19/h4-15H,1-3H3
InChIKey SIQWOLRCQMVHSF-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C24H21NO3S
Exact Mass 403.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMHKiWKSQFi
Name 1,2,2-tris(p-methoxyphenyl)ethenyl thiocyanate
Alternate Name(s) 1,2,2-tris(4-methoxyphenyl)vinyl thiocyanate
CAS Registry Number 93119-50-7
Comments Less than 3 mono-isotopic peaks
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Formula C24H21NO3S
InChI InChI=1S/C24H21NO3S/c1-26-20-10-4-17(5-11-20)23(18-6-12-21(27-2)13-7-18)24(29-16-25)19-8-14-22(28-3)15-9-19/h4-15H,1-3H3
InChIKey SIQWOLRCQMVHSF-UHFFFAOYSA-N
Molecular Weight 403.496 g/mol
SMILES C(=C(c1ccc(cc1)OC)SC#N)(c1ccc(cc1)OC)c1ccc(cc1)OC
SPLASH splash10-0udj-0005900000-382946176a54fe115431
Source of Spectrum J-55-1805-5
Wiley ID 1370915