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(E)-Methyl 3-benzyl-5-chloro-4-methyldec-4-enoate
SpectraBase Compound ID FyEetpuQ8ZI
InChI InChI=1S/C19H27ClO2/c1-4-5-7-12-18(20)15(2)17(14-19(21)22-3)13-16-10-8-6-9-11-16/h6,8-11,17H,4-5,7,12-14H2,1-3H3/b18-15+
InChIKey QLCIWQWHXRJELO-OBGWFSINSA-N
Mol Weight 322.88 g/mol
Molecular Formula C19H27ClO2
Exact Mass 322.169958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GE2vCt4oYsL
Name (E)-Methyl 3-benzyl-5-chloro-4-methyldec-4-enoate
Appearance Colorless thick oil
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Exact Mass 322.169957807 u
Formula C19H27ClO2
InChI InChI=1S/C19H27ClO2/c1-4-5-7-12-18(20)15(2)17(14-19(21)22-3)13-16-10-8-6-9-11-16/h6,8-11,17H,4-5,7,12-14H2,1-3H3/b18-15+
InChIKey QLCIWQWHXRJELO-OBGWFSINSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201803541
Molecular Weight 322.876 g/mol
Quality 469
SMILES COC(CC(\C(=C/(CCCCC)Cl)C)CC1=CC=CC=C1)=O
SPLASH splash10-0006-6920000000-255a70c7860da9e7a50e
Source of Spectrum ACI-57-SM26-15 (DOI: 10.1002/anie.201803541)
Wiley ID 1893178