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N-acetyl W-19
SpectraBase Compound ID 1tzhsxm9pj5
InChI InChI=1S/C21H24ClN3O3S/c1-16(26)23-19-9-5-17(6-10-19)13-15-25-14-3-2-4-21(25)24-29(27,28)20-11-7-18(22)8-12-20/h5-12H,2-4,13-15H2,1H3,(H,23,26)/b24-21-
InChIKey POQUVOZXJFOPBC-FLFQWRMESA-N
Mol Weight 433.95 g/mol
Molecular Formula C21H24ClN3O3S
Exact Mass 433.122691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3gjeLlt4fT
Name N-acetyl W-19
Catalog Number 20266
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24ClN3O3S
InChI InChI=1S/C21H24ClN3O3S/c1-16(26)23-19-9-5-17(6-10-19)13-15-25-14-3-2-4-21(25)24-29(27,28)20-11-7-18(22)8-12-20/h5-12H,2-4,13-15H2,1H3,(H,23,26)/b24-21-
InChIKey POQUVOZXJFOPBC-FLFQWRMESA-N
Molecular Weight 433.954 g/mol
SMILES N(c1ccc(CCN2\C(CCCC2)=N\S(c2ccc(cc2)Cl)(=O)=O)cc1)C(C)=O
SPLASH splash10-03xr-3920000000-23a5bf379bd5597d3b35
Source of Spectrum CAY-2023-656-0
Wiley ID 1888615