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4-(2',3'-Diacetoxypropylidene)-2-tosyl-2,3,3a,4-tetrahydro-1H-cyclopenta[c]pyrrole-5-one
SpectraBase Compound ID aFhZO5mIEu
InChI InChI=1S/C21H23NO7S/c1-13-4-6-18(7-5-13)30(26,27)22-10-16-8-21(25)19(20(16)11-22)9-17(29-15(3)24)12-28-14(2)23/h4-9,17,20H,10-12H2,1-3H3/b19-9+
InChIKey HFLNCBSWOCEIEB-DJKKODMXSA-N
Mol Weight 433.48 g/mol
Molecular Formula C21H23NO7S
Exact Mass 433.119523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47GKcubH0a
Name 4-(2',3'-Diacetoxypropylidene)-2-tosyl-2,3,3a,4-tetrahydro-1H-cyclopenta[c]pyrrole-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO7S
InChI InChI=1S/C21H23NO7S/c1-13-4-6-18(7-5-13)30(26,27)22-10-16-8-21(25)19(20(16)11-22)9-17(29-15(3)24)12-28-14(2)23/h4-9,17,20H,10-12H2,1-3H3/b19-9+
InChIKey HFLNCBSWOCEIEB-DJKKODMXSA-N
Molecular Weight 433.475 g/mol
SMILES C1N(S(c2ccc(cc2)C)(=O)=O)CC2=CC(\C(C12)=C/C(OC(=O)C)COC(=O)C)=O
SPLASH splash10-01b9-2009000000-fcf92e8af435fa0d7424
Source of Spectrum J-67-3509-9
Synonyms 2-(acetyloxy)-1-[(E)-(2-[(4-methylphenyl)sulfonyl]-5-oxo-2,3,3a,5-tetrahydrocyclopenta[c]pyrrol-4(1H)-ylidene)methyl]ethyl acetate
Wiley ID 1569855