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Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-
SpectraBase Compound ID IpIlrTKUOJu
InChI InChI=1S/C14H11NO2S/c16-15(17)13-6-8-14(9-7-13)18-11-10-12-4-2-1-3-5-12/h1-11H/b11-10+
InChIKey GUSCIMGPTLXFGN-ZHACJKMWSA-N
Mol Weight 257.31 g/mol
Molecular Formula C14H11NO2S
Exact Mass 257.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8pPTAtSng3m
Name Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-
Alternate Name(s) (4-Nitrophenyl)(styryl)sulfane 1-Nitro-4-((E)-styrylsulfanyl)-benzene 1-nitro-4-[[(E)-2-phenylethenyl]thio]benzene 1-nitro-4-[(E)-styryl]sulfanyl-benzene 1-nitro-4-[[(E)-styryl]thio]benzene 1-nitro-4-[(E)-2-phenylethenyl]sulfanylbenzene 1-nitro-4-[(E)-2-phenylethenyl]sulfanyl-benzene
CAS Registry Number 128183-94-8
Comments Less than 3 mono-isotopic peaks
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Formula C14H11NO2S
InChI InChI=1S/C14H11NO2S/c16-15(17)13-6-8-14(9-7-13)18-11-10-12-4-2-1-3-5-12/h1-11H/b11-10+
InChIKey GUSCIMGPTLXFGN-ZHACJKMWSA-N
Molecular Weight 257.307 g/mol
SMILES c1(N(=O)=O)ccc(S\C=C\c2ccccc2)cc1
SPLASH splash10-0a4i-3090000000-18a22ca071f83c5c04bb
Source of Spectrum O-25-162-2
Wiley ID 1260750