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Propionic acid, 3-[[2-(carboxyamino)ethyl]dithio]-, N-benzyl methyl ester
SpectraBase Compound ID 75Zk0hG23nO
InChI InChI=1S/C14H19NO4S2/c1-18-13(16)7-9-20-21-10-8-15-14(17)19-11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,15,17)
InChIKey XYQFUVVNJWEEET-UHFFFAOYSA-N
Mol Weight 329.43 g/mol
Molecular Formula C14H19NO4S2
Exact Mass 329.07555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BoHd6JNRxB
Name Propionic acid, 3-[[2-(carboxyamino)ethyl]dithio]-, N-benzyl methyl ester
Alternate Name(s) Methyl 3-[(2-([(benzyloxy)carbonyl]amino)ethyl)disulfanyl]propanoate 3-[2-(benzyloxycarbonylamino)ethyldisulfanyl]propionic acid methyl ester 3-[2-(phenylmethoxycarbonylamino)ethyldisulfanyl]propanoic acid methyl ester Methyl 3-[2-(phenylmethoxycarbonylamino)ethyldisulfanyl]propanoate
CAS Registry Number 26599-16-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO4S2
InChI InChI=1S/C14H19NO4S2/c1-18-13(16)7-9-20-21-10-8-15-14(17)19-11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,15,17)
InChIKey XYQFUVVNJWEEET-UHFFFAOYSA-N
Molecular Weight 329.429 g/mol
SMILES N(CCSSCCC(=O)OC)C(=O)OCc1ccccc1
SPLASH splash10-0006-9200000000-a363d650bf575d1f44d0
Source of Spectrum J-6-79-6
Wiley ID 1326956