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Benzyl [4'-nitrophenylthio]-acetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Benzyl [4'-nitrophenylthio]-acetate
SpectraBase Compound ID 4BYHEM1940q
InChI InChI=1S/C15H13NO4S/c17-15(20-10-12-4-2-1-3-5-12)11-21-14-8-6-13(7-9-14)16(18)19/h1-9H,10-11H2
InChIKey AYZMPXWGGVAKKW-UHFFFAOYSA-N
Mol Weight 303.33 g/mol
Molecular Formula C15H13NO4S
Exact Mass 303.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ffg15wmg3hy
Name Benzyl [4'-nitrophenylthio]-acetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO4S
InChI InChI=1S/C15H13NO4S/c17-15(20-10-12-4-2-1-3-5-12)11-21-14-8-6-13(7-9-14)16(18)19/h1-9H,10-11H2
InChIKey AYZMPXWGGVAKKW-UHFFFAOYSA-N
Molecular Weight 303.332 g/mol
SMILES c1(N(=O)=O)ccc(SCC(=O)OCc2ccccc2)cc1
SPLASH splash10-0udi-0900000000-462cd42a34beb4d6dae8
Source of Spectrum H-85-4295-11
Synonyms benzyl[(4-nitrophenyl)sulfanyl]acetate
Wiley ID 1525157