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(E)-Ethyl 3-(indol-3-yl)prop-2-enoate
SpectraBase Compound ID 8ZRnWCgvt5Q
InChI InChI=1S/C13H13NO2/c1-2-16-13(15)8-7-10-9-14-12-6-4-3-5-11(10)12/h3-9,14H,2H2,1H3/b8-7+
InChIKey OQJSITNIWIYWPU-BQYQJAHWSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPLysnbUvmd
Name (E)-Ethyl 3-(indol-3-yl)prop-2-enoate
Alternate Name(s) (E)-3-(1H-indol-3-yl)-2-propenoic acid ethyl ester (E)-3-(1H-indol-3-yl)acrylic acid ethyl ester Ethyl (2E)-3-(1H-indol-3-yl)-2-propenoate ethyl (E)-3-(1H-indol-3-yl)prop-2-enoate Ethyl indole-3-acrylate
CAS Registry Number 15181-86-9
Comments Less than 3 mono-isotopic peaks
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Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c1-2-16-13(15)8-7-10-9-14-12-6-4-3-5-11(10)12/h3-9,14H,2H2,1H3/b8-7+
InChIKey OQJSITNIWIYWPU-BQYQJAHWSA-N
Molecular Weight 215.252 g/mol
SMILES [nH]1c2c(c(c1)\C=C\C(=O)OCC)cccc2
SPLASH splash10-014i-0190000000-8c378dbae9033158fad3
Source of Spectrum J-58-5787-9
Wiley ID 1214689