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2-(Phenylthio)ethyl 3-(1,3-dioxolan-2-yl)propanoate
SpectraBase Compound ID 9T104PYgxRh
InChI InChI=1S/C14H18O4S/c15-13(6-7-14-17-8-9-18-14)16-10-11-19-12-4-2-1-3-5-12/h1-5,14H,6-11H2
InChIKey ONRMTAYVUOQBCX-UHFFFAOYSA-N
Mol Weight 282.35 g/mol
Molecular Formula C14H18O4S
Exact Mass 282.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERQNsYx492N
Name 2-(Phenylthio)ethyl 3-(1,3-dioxolan-2-yl)propanoate
Appearance Colorless oil
Carrier Gas Argon
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Exact Mass 282.092580230 u
Formula C14H18O4S
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C14H18O4S/c15-13(6-7-14-17-8-9-18-14)16-10-11-19-12-4-2-1-3-5-12/h1-5,14H,6-11H2
InChIKey ONRMTAYVUOQBCX-UHFFFAOYSA-N
Instrument Name Agilent HP-7890A-AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202211939
Quality 184
Reported Formula C14H18O4S
SMILES C1(=CC=CC=C1)SCCOC(CCC1OCCO1)=O
SPLASH splash10-0079-5900000000-1ec3359169cbe6deaee5
Source of Spectrum ACI-61-SM24-13 (DOI: 10.1002/anie.202211939)
Wiley ID 1899529