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Methyl (E)-3-[4-Bromo-1-[(E)-2-(phenylsulfonyl)ethenyl]butoxy]propenoate
SpectraBase Compound ID 2lVI9CzEmlm
InChI InChI=1S/C16H19BrO5S/c1-21-16(18)9-12-22-14(6-5-11-17)10-13-23(19,20)15-7-3-2-4-8-15/h2-4,7-10,12-14H,5-6,11H2,1H3/b12-9+,13-10+
InChIKey HMRKFVMOFKZERX-JOWSBRCASA-N
Mol Weight 403.29 g/mol
Molecular Formula C16H19BrO5S
Exact Mass 402.013658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jw6IBSDf6Pm
Name Methyl (E)-3-[4-Bromo-1-[(E)-2-(phenylsulfonyl)ethenyl]butoxy]propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19BrO5S
InChI InChI=1S/C16H19BrO5S/c1-21-16(18)9-12-22-14(6-5-11-17)10-13-23(19,20)15-7-3-2-4-8-15/h2-4,7-10,12-14H,5-6,11H2,1H3/b12-9+,13-10+
InChIKey HMRKFVMOFKZERX-JOWSBRCASA-N
Molecular Weight 403.287 g/mol
SMILES C(\C=C\S(=O)(=O)c1ccccc1)(O\C=C\C(=O)OC)CCCBr
SPLASH splash10-004i-7921000000-f864be926e49c9b3e0ec
Source of Spectrum F-54-1610-14
Wiley ID 805664