Debug Info

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25XIZ722LD4
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25XIZ722LD4
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Mass Spectrum (GC)
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(E)-butyl 3-(5-bromo-1H-indol-3-yl)acrylate
SpectraBase Compound ID cgodPndtwa
InChI InChI=1S/C15H16BrNO2/c1-2-3-8-19-15(18)7-4-11-10-17-14-6-5-12(16)9-13(11)14/h4-7,9-10,17H,2-3,8H2,1H3/b7-4+
InChIKey DFNOBZWWDZQGQB-QPJJXVBHSA-N
Mol Weight 322.2 g/mol
Molecular Formula C15H16BrNO2
Exact Mass 321.036442 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25XIZ722LD4
Name (E)-butyl 3-(5-bromo-1H-indol-3-yl)acrylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16BrNO2
InChI InChI=1S/C15H16BrNO2/c1-2-3-8-19-15(18)7-4-11-10-17-14-6-5-12(16)9-13(11)14/h4-7,9-10,17H,2-3,8H2,1H3/b7-4+
InChIKey DFNOBZWWDZQGQB-QPJJXVBHSA-N
Literature Reference DOI 10.1002/adsc.201201114
Molecular Weight 322.202 g/mol
SMILES [nH]1cc(c2c1ccc(c2)Br)\C=C\C(OCCCC)=O
SPLASH splash10-01b9-1942000000-b93be6a81b372719f732
Source of Spectrum ASC-355-1512/SM4-3f
Synonyms (E)-3-(5-bromo-1H-indol-3-yl)-2-propenoic acid butyl ester Butyl (E)-3-(5-bromo-1H-indol-3-yl)prop-2-enoate Butyl (E)-3-(5-bromanyl-1H-indol-3-yl)prop-2-enoate
Wiley ID 1762066
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