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Methyl 2,3-dideuterio-5-phenyl-2(E)-pentenoate
SpectraBase Compound ID DP0OgoRKz0f
InChI InChI=1S/C12H14O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,6-8,10H,5,9H2,1H3/b10-6+/i6D,10D
InChIKey KRQKLKAPNGLSMF-WBDJPMCCSA-N
Mol Weight 192.25 g/mol
Molecular Formula C12H12D2O2
Exact Mass 192.111933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3pMB2SjgY1
Name Methyl 2,3-dideuterio-5-phenyl-2(E)-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12D2O2
InChI InChI=1S/C12H14O2/c1-14-12(13)10-6-5-9-11-7-3-2-4-8-11/h2-4,6-8,10H,5,9H2,1H3/b10-6+/i6D,10D
InChIKey KRQKLKAPNGLSMF-WBDJPMCCSA-N
Molecular Weight 192.254 g/mol
SMILES C(\C(=C\(CCc1ccccc1)[D])[D])(=O)OC
SPLASH splash10-0006-9200000000-6fcd1c82f29dd2f2bb12
Source of Spectrum SK-30-114-11
Synonyms (E)-2,3-dideuterio-5-phenyl-2-pentenoic acid methyl ester Methyl (E)-2,3-dideuterio-5-phenylpent-2-enoate Methyl (E)-2,3-dideuterio-5-phenyl-pent-2-enoate
Wiley ID 881057