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t-Butyl 7-phenyl-5H-furo[2,3-c]]thiopyran-4-carboxylate
SpectraBase Compound ID KjA9aA4qTNJ
InChI InChI=1S/C18H18O3S/c1-18(2,3)21-17(19)14-11-22-16(12-7-5-4-6-8-12)15-13(14)9-10-20-15/h4-10H,11H2,1-3H3
InChIKey NKYXZZJMKWKJJE-UHFFFAOYSA-N
Mol Weight 314.4 g/mol
Molecular Formula C18H18O3S
Exact Mass 314.097666 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUBiDqDfKGe
Name t-Butyl 7-phenyl-5H-furo[2,3-c]]thiopyran-4-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O3S
InChI InChI=1S/C18H18O3S/c1-18(2,3)21-17(19)14-11-22-16(12-7-5-4-6-8-12)15-13(14)9-10-20-15/h4-10H,11H2,1-3H3
InChIKey NKYXZZJMKWKJJE-UHFFFAOYSA-N
Molecular Weight 314.399 g/mol
SMILES C1(=C2C(OC=C2)=C(SC1)c1ccccc1)C(OC(C)(C)C)=O
SPLASH splash10-0a4i-0092000000-5cdc6a3f27b12069b70a
Source of Spectrum SO-0-729-7
Wiley ID 1544934
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