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4-(1-(5-chlorothiophen-2-yl)-2-methylpropyl)phenyl pivalate
SpectraBase Compound ID H6JU8dbYL4K
InChI InChI=1S/C19H23ClO2S/c1-12(2)17(15-10-11-16(20)23-15)13-6-8-14(9-7-13)22-18(21)19(3,4)5/h6-12,17H,1-5H3
InChIKey LWUJKYVFKMYCRB-UHFFFAOYSA-N
Mol Weight 350.9 g/mol
Molecular Formula C19H23ClO2S
Exact Mass 350.110729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKrKCydX1mG
Name 4-(1-(5-chlorothiophen-2-yl)-2-methylpropyl)phenyl pivalate
Appearance Yellow oil
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Formula C19H23ClO2S
InChI InChI=1S/C19H23ClO2S/c1-12(2)17(15-10-11-16(20)23-15)13-6-8-14(9-7-13)22-18(21)19(3,4)5/h6-12,17H,1-5H3
InChIKey LWUJKYVFKMYCRB-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016268
Molecular Weight 350.904 g/mol
SMILES c1(C(c2ccc(s2)Cl)C(C)C)ccc(cc1)OC(C(C)(C)C)=O
SPLASH splash10-0ab9-6295000000-3fa7fabf3b8e8390eea7
Source of Spectrum ACI-60-SM28-4g
Wiley ID 1880272