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(r)-3-Hydroxy-5-oxohexanoic acid - (S)-[2'-(Acetylamino)ethyl] Thioester
SpectraBase Compound ID 8RrmKbxQJmw
InChI InChI=1S/C10H17NO4S/c1-7(12)5-9(14)6-10(15)16-4-3-11-8(2)13/h9,14H,3-6H2,1-2H3,(H,11,13)/t9-/m1/s1
InChIKey YSBZUHYQPIXQPH-SECBINFHSA-N
Mol Weight 247.31 g/mol
Molecular Formula C10H17NO4S
Exact Mass 247.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTpbGMePJjD
Name (r)-3-Hydroxy-5-oxohexanoic acid - (S)-[2'-(Acetylamino)ethyl] Thioester
Alternate Name(s) (R)-S-(2-acetamidoethyl) 3-hydroxy-5-oxohexanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17NO4S
InChI InChI=1S/C10H17NO4S/c1-7(12)5-9(14)6-10(15)16-4-3-11-8(2)13/h9,14H,3-6H2,1-2H3,(H,11,13)/t9-/m1/s1
InChIKey YSBZUHYQPIXQPH-SECBINFHSA-N
Molecular Weight 247.309 g/mol
SMILES N(C(C)=O)CCSC(C[C@](O)(CC(C)=O)[H])=O
SPLASH splash10-02t9-9530000000-933836d5a23d6b4e2773
Source of Spectrum F5-3-1726-R--40
Wiley ID 1732259