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3-[1-(2,5-dimethyl-1H-pyrrol-3-yl)ethenyl]-1H-indole
SpectraBase Compound ID 6aV6b6m7BpZ
InChI InChI=1S/C16H16N2/c1-10-8-14(12(3)18-10)11(2)15-9-17-16-7-5-4-6-13(15)16/h4-9,17-18H,2H2,1,3H3
InChIKey XIPHFLOQXGRZCF-UHFFFAOYSA-N
Mol Weight 236.32 g/mol
Molecular Formula C16H16N2
Exact Mass 236.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BNcs1bWp9E
Name 3-[1-(2,5-dimethyl-1H-pyrrol-3-yl)ethenyl]-1H-indole
Alternate Name(s) 3-[1-(2,5-dimethyl-1H-pyrrol-3-yl)vinyl]-1H-indole
CAS Registry Number 113685-38-4
Comments Less than 3 mono-isotopic peaks
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Formula C16H16N2
InChI InChI=1S/C16H16N2/c1-10-8-14(12(3)18-10)11(2)15-9-17-16-7-5-4-6-13(15)16/h4-9,17-18H,2H2,1,3H3
InChIKey XIPHFLOQXGRZCF-UHFFFAOYSA-N
Molecular Weight 236.318 g/mol
SMILES [nH]1c2c(c(C(c3c([nH]c(c3)C)C)=C)c1)cccc2
SPLASH splash10-0006-9000000000-d9252d6c16d3916ac06c
Source of Spectrum AH-118-1037-12
Wiley ID 1238974