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Benzenehexanoic acid, 4-chloro-3-methoxy-.alpha.-(methoxymethylene)-.beta.-methyl-, methyl ester, (E)-
SpectraBase Compound ID DrjmmwFrUUC
InChI InChI=1S/C17H23ClO4/c1-12(14(11-20-2)17(19)22-4)6-5-7-13-8-9-15(18)16(10-13)21-3/h8-12H,5-7H2,1-4H3/b14-11+
InChIKey UATPYSSSUYYELE-SDNWHVSQSA-N
Mol Weight 326.82 g/mol
Molecular Formula C17H23ClO4
Exact Mass 326.128487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cw7oM6WnLlh
Name Benzenehexanoic acid, 4-chloro-3-methoxy-.alpha.-(methoxymethylene)-.beta.-methyl-, methyl ester, (E)-
CAS Registry Number 67781-29-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23ClO4
InChI InChI=1S/C17H23ClO4/c1-12(14(11-20-2)17(19)22-4)6-5-7-13-8-9-15(18)16(10-13)21-3/h8-12H,5-7H2,1-4H3/b14-11+
InChIKey UATPYSSSUYYELE-SDNWHVSQSA-N
Molecular Weight 326.820 g/mol
SMILES C(\C(=C\OC)C(CCCc1cc(OC)c(cc1)Cl)C)(=O)OC
SPLASH splash10-004l-9750000000-b80f29329650577d3aa0
Source of Spectrum K-111-2784-0
Synonyms Methyl (2E)-2-[4-(4-chloro-3-methoxyphenyl)-1-methylbutyl]-3-methoxy-2-propenoate Tetrahydrostrobilurin B
Wiley ID 1324655