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4-DEOXYTHEBAINOL A

View entire compound with spectra: 1 FTIR

4-DEOXYTHEBAINOL A
SpectraBase Compound ID JvNOYNTgr42
InChI InChI=1S/C18H23NO2/c1-19-8-7-18-11-13(20)4-6-15(18)17(19)9-12-3-5-14(21-2)10-16(12)18/h3-6,10,13,15,17,20H,7-9,11H2,1-2H3/t13-,15+,17-,18+/m1/s1
InChIKey BHVAKFDUWLACNI-SIUPPRGNSA-N
Mol Weight 285.39 g/mol
Molecular Formula C18H23NO2
Exact Mass 285.172879 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID GpycxmhBCDR
Name 4-DEOXYTHEBAINOL A
Source of Sample Y. K. Sawa, Shionogi Company, Osaka, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO2
InChI InChI=1S/C18H23NO2/c1-19-8-7-18-11-13(20)4-6-15(18)17(19)9-12-3-5-14(21-2)10-16(12)18/h3-6,10,13,15,17,20H,7-9,11H2,1-2H3/t13-,15+,17-,18+/m1/s1
InChIKey BHVAKFDUWLACNI-SIUPPRGNSA-N
Literature Reference Abstract-Chemical Abstracts= 62, 596(1965)
Melting Point 150-151.5C
Molecular Weight 285.386993
Optical Properties Optical Rotation= (26C) -47.6 +/- 2 DEG (c=1.039, ALCOHOL)
Synonyms MORPHINAN, 7-DEHYDRO-6B-HYDROXY- 3-METHOXY-N-METHYL-, THEBAINOL A, 4-DEOXY-, IMINOETHANOPHENANTHREN-3-OL, 4H-10,4A-, 6-METHOXY-11-METHYL- 3,9,10,CIS-10A-TETRAHYDRO-,
Technique KBr WAFER