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(S)-Methyl 3-(4-bromophenyl)-3-cyanopropanoate
SpectraBase Compound ID JBawYxt2r1c
InChI InChI=1S/C11H10BrNO2/c1-15-11(14)6-9(7-13)8-2-4-10(12)5-3-8/h2-5,9H,6H2,1H3/t9-/m1/s1
InChIKey JYGMYDOUINVBRU-SECBINFHSA-N
Mol Weight 268.11 g/mol
Molecular Formula C11H10BrNO2
Exact Mass 266.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoM2PkN3TXP
Name (S)-Methyl 3-(4-bromophenyl)-3-cyanopropanoate
Alternate Name(s) Methyl (S)-3-(4-bromophenyl)-3-cyanopropanoate
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Formula C11H10BrNO2
InChI InChI=1S/C11H10BrNO2/c1-15-11(14)6-9(7-13)8-2-4-10(12)5-3-8/h2-5,9H,6H2,1H3/t9-/m1/s1
InChIKey JYGMYDOUINVBRU-SECBINFHSA-N
Molecular Weight 268.110 g/mol
SMILES c1cc(ccc1Br)[C@](CC(OC)=O)(C#N)[H]
SPLASH splash10-0aou-0390000000-2f71c3aa93220ed25861
Source of Spectrum ASC-357-SM10-(S)_2d
Wiley ID 1785090