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Acetic acid (R)-[5-(6-chloro-benzothiazol-2-yl)-furan-2-yl]-cyano-methyl ester
SpectraBase Compound ID DBBbpD402Pr
InChI InChI=1S/C15H9ClN2O3S/c1-8(19)20-13(7-17)11-4-5-12(21-11)15-18-10-3-2-9(16)6-14(10)22-15/h2-6,13H,1H3/t13-/m1/s1
InChIKey KUQCYRKYNYYSSL-CYBMUJFWSA-N
Mol Weight 332.76 g/mol
Molecular Formula C15H9ClN2O3S
Exact Mass 332.002241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42wlEVZzkG
Name Acetic acid (R)-[5-(6-chloro-benzothiazol-2-yl)-furan-2-yl]-cyano-methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9ClN2O3S
InChI InChI=1S/C15H9ClN2O3S/c1-8(19)20-13(7-17)11-4-5-12(21-11)15-18-10-3-2-9(16)6-14(10)22-15/h2-6,13H,1H3/t13-/m1/s1
InChIKey KUQCYRKYNYYSSL-CYBMUJFWSA-N
Molecular Weight 332.761 g/mol
SMILES c1(nc2ccc(cc2s1)Cl)-c1oc([C@@](C#N)(OC(=O)C)[H])cc1
SPLASH splash10-006x-0091000000-97b755a61e5acb7aab61
Source of Spectrum KD-14-625-2
Synonyms (R)-[5-(6-chloro-1,3-benzothiazol-2-yl)-2-furyl](cyano)methyl acetate 5-(6-Chlorobenzothiazol-2-yl)furan-2-ylcyanomethylacetate
Wiley ID 1635862