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Methyl (Z)-[3,4-2H2]Hex-3-enoate
SpectraBase Compound ID K8wrKTJ0yoE
InChI InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h4-5H,3,6H2,1-2H3/b5-4-/i4D,5D
InChIKey XEAIHUDTEINXFG-IMZGHRNZSA-N
Mol Weight 130.18 g/mol
Molecular Formula C7H10D2O2
Exact Mass 130.096283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVeCW8T3KWs
Name Methyl (Z)-[3,4-2H2]Hex-3-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10D2O2
InChI InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h4-5H,3,6H2,1-2H3/b5-4-/i4D,5D
InChIKey XEAIHUDTEINXFG-IMZGHRNZSA-N
Literature Reference DOI 10.1002/cbdv.200890089
Molecular Weight 130.183 g/mol
SMILES C(OC)(=O)C\C(=C/([D])CC)[D]
SPLASH splash10-00di-9100000000-a6ac2cea74d296f06675
Source of Spectrum CBD-5-1132-25
Synonyms Methyl (Z)-hex-3-enoate-3,4-d2
Wiley ID 1788766