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3-Bromo-A-cyano-cinnamic acid, ethyl ester
SpectraBase Compound ID E3vC3iZfL4f
InChI InChI=1S/C12H10BrNO2/c1-2-16-12(15)10(8-14)6-9-4-3-5-11(13)7-9/h3-7H,2H2,1H3/b10-6+
InChIKey OTVZAMWNYOAFBV-UXBLZVDNSA-N
Mol Weight 280.12 g/mol
Molecular Formula C12H10BrNO2
Exact Mass 278.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KWNv1GWchz
Name Ethyl (2E)-3-(3-bromophenyl)-2-cyano-2-propenoate
CAS Registry Number 24398-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10BrNO2
InChI InChI=1S/C12H10BrNO2/c1-2-16-12(15)10(8-14)6-9-4-3-5-11(13)7-9/h3-7H,2H2,1H3/b10-6+
InChIKey OTVZAMWNYOAFBV-UXBLZVDNSA-N
Molecular Weight 280.121 g/mol
SMILES CCOC(=O)\C(=C\c1cc(Br)ccc1)C#N
SPLASH splash10-0fc0-3490000000-e4ccaa2bd4032e95687b
Source of Spectrum W5-1989-14466-1
Synonyms (E)-3-(3-bromophenyl)-2-cyano-2-propenoic acid ethyl ester (E)-3-(3-bromophenyl)-2-cyano-acrylic acid ethyl ester 2-Propenoic acid, 2-cyano-3-(3-bromophenyl)-, ethyl ester Ethyl (E)-3-(3-bromophenyl)-2-cyano-prop-2-enoate
Wiley ID 1282757