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N-[2-(4-oxopent-2-ene)]cysteine methyl ester disulfide
SpectraBase Compound ID 5LgJ4YQD4uh
InChI InChI=1S/C18H28N2O6S2/c1-13(21)7-5-9-19-15(17(23)25-3)11-27-28-12-16(18(24)26-4)20-10-6-8-14(2)22/h5-8,15-16,19-20H,9-12H2,1-4H3/b7-5-,8-6-
InChIKey SCSXEHXDVXEMEY-SFECMWDFSA-N
Mol Weight 432.55 g/mol
Molecular Formula C18H28N2O6S2
Exact Mass 432.138879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fp3JF30COQH
Name N-[2-(4-oxopent-2-ene)]cysteine methyl ester disulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28N2O6S2
InChI InChI=1S/C18H28N2O6S2/c1-13(21)7-5-9-19-15(17(23)25-3)11-27-28-12-16(18(24)26-4)20-10-6-8-14(2)22/h5-8,15-16,19-20H,9-12H2,1-4H3/b7-5-,8-6-
InChIKey SCSXEHXDVXEMEY-SFECMWDFSA-N
Molecular Weight 432.550 g/mol
SMILES N(C(CSSCC(C(=O)OC)NC\C=C/C(=O)C)C(=O)OC)C\C=C/C(=O)C
SPLASH splash10-01b9-0890000000-8316930bf2d86ca28deb
Source of Spectrum J-64-7231-0
Wiley ID 1531053