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(2S)-2-phenethylsulfanylpropanoate

(2S)-2-phenethylsulfanylpropanoate

Systemtic Name:(2S)-2-phenethylsulfanylpropanoate
Openeye Name:(2S)-2-phenethylsulfanylpropanoate
CAS Name:(2S)-2-(phenethylthio)propanoate
IUPAC Name:(2S)-2-phenethylsulfanylpropanoate
Traditional Name:(2S)-2-(phenethylthio)propionate
Formula: C11H13O2S-
MolecularWeight: 209.28472
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SCCC1=CC=CC=C1


Isomeric SMILES

C[C@@H](C(=O)[O-])SCCC1=CC=CC=C1


InChI

InChI=1S/C11H14O2S/c1-9(11(12)13)14-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)/p-1/t9-/m0/s1


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