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L-Cysteine, S,S'-1H-indole-2,3-diylbis[N-acetyl-, dimethyl ester
SpectraBase Compound ID 3l1K5aavFI9
InChI InChI=1S/C20H25N3O6S2/c1-11(24)21-15(19(26)28-3)9-30-17-13-7-5-6-8-14(13)23-18(17)31-10-16(20(27)29-4)22-12(2)25/h5-8,15-16,23H,9-10H2,1-4H3,(H,21,24)(H,22,25)/t15-,16-/m0/s1
InChIKey DUBBTHSLGNEZQB-HOTGVXAUSA-N
Mol Weight 467.56 g/mol
Molecular Formula C20H25N3O6S2
Exact Mass 467.118478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZIALrzX0nK
Name L-Cysteine, S,S'-1H-indole-2,3-diylbis[N-acetyl-, dimethyl ester
CAS Registry Number 109075-15-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25N3O6S2
InChI InChI=1S/C20H25N3O6S2/c1-11(24)21-15(19(26)28-3)9-30-17-13-7-5-6-8-14(13)23-18(17)31-10-16(20(27)29-4)22-12(2)25/h5-8,15-16,23H,9-10H2,1-4H3,(H,21,24)(H,22,25)/t15-,16-/m0/s1
InChIKey DUBBTHSLGNEZQB-HOTGVXAUSA-N
Molecular Weight 467.555 g/mol
SMILES [nH]1c2ccccc2c(c1SC[C@@](C(=O)OC)(NC(=O)C)[H])SC[C@@](C(=O)OC)(NC(=O)C)[H]
SPLASH splash10-0006-0900100000-f92bff7847f83d63f5c6
Source of Spectrum F-42-4514-9
Synonyms 2,3-Di-(l)(2-methoxycarbonyl-2-methylcarbonylamino-ethyl)-1-benzazole Methyl (2R)-2-(acetylamino)-3-[(2-{[(2R)-2-(acetylamino)-3-methoxy-3-oxopropyl]sulfanyl}-1H-indol-3-yl)sulfanyl]propanoate
Wiley ID 1392138