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N-[1,3-dimethoxy-2-hydroxy-10-(methylthio)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7alpha-yl]acetamide
SpectraBase Compound ID GcetZoxCfIe
InChI InChI=1S/C21H23NO5S/c1-11(23)22-15-7-5-12-9-17(26-2)20(25)21(27-3)19(12)13-6-8-18(28-4)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)/t15-/m0/s1
InChIKey OMQLBXIHBJAOIO-HNNXBMFYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H23NO5S
Exact Mass 401.129694 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID OiDIzwvsC8
Name N-[1,3-DIMETHOXY-2-HYDROXY-10-(METHYLTHIO)-9-OXO-5,6,7,9-TETRAHYDROBENZO[a]HEPTALEN-7alpha-YL]ACETAMIDE
Source of Sample A. Brossi and P. N. Sharma, Nih, Bethesda, Maryland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO5S
InChI InChI=1S/C21H23NO5S/c1-11(23)22-15-7-5-12-9-17(26-2)20(25)21(27-3)19(12)13-6-8-18(28-4)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)/t15-/m0/s1
InChIKey OMQLBXIHBJAOIO-HNNXBMFYSA-N
Literature Reference HETEROCYCLES 20, 1587(1983) Abstract-Chemical Abstracts= 99, 158744(1983)
Molecular Weight 401.476990
Synonyms ACETAMIDE, N-/1,3-DIMETHOXY- 2-HYDROXY-10-/METHYLTHIO/-9-OXO- 5,6,7,9-TETRAHYDROBENZO/A/HEPTALEN- 7A-YL/-, THIOCOLCHICINE, 2-DEMETHYL-,
Technique KBr WAFER