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N-Phthaloyl-D-ethionine

View entire compound with spectra: 1 MS (GC)

N-Phthaloyl-D-ethionine
SpectraBase Compound ID BHeuJLNaOnT
InChI InChI=1S/C14H15NO4S/c1-2-20-8-7-11(14(18)19)15-12(16)9-5-3-4-6-10(9)13(15)17/h3-6,11H,2,7-8H2,1H3,(H,18,19)/t11-/m1/s1
InChIKey VJWLRKKNSYSFNY-LLVKDONJSA-N
Mol Weight 293.34 g/mol
Molecular Formula C14H15NO4S
Exact Mass 293.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34lVUHuKPe9
Name N-Phthaloyl-D-ethionine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO4S
InChI InChI=1S/C14H15NO4S/c1-2-20-8-7-11(14(18)19)15-12(16)9-5-3-4-6-10(9)13(15)17/h3-6,11H,2,7-8H2,1H3,(H,18,19)/t11-/m1/s1
InChIKey VJWLRKKNSYSFNY-LLVKDONJSA-N
Molecular Weight 293.337 g/mol
SMILES OC([C@](N1C(c2ccccc2C1=O)=O)(CCSCC)[H])=O
SPLASH splash10-0a4r-0980000000-43a36f3af817de0e7985
Source of Spectrum QC-10-2838-2
Wiley ID 871558