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Thebaine

View entire compound with spectra: 10 NMR, 3 FTIR, 1 Raman, and 9 MS (GC)

Thebaine
SpectraBase Compound ID Cdxzh4df9we
InChI InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18+,19+/m1/s1
InChIKey FQXXSQDCDRQNQE-VMDGZTHMSA-N
Mol Weight 311.38 g/mol
Molecular Formula C19H21NO3
Exact Mass 311.152144 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4Ai9aRTXz7Q
Name THEBAINE
Source of Sample I. Lalezari, University of Tehran, Tehran, Iran
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO3
InChI InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18+,19+/m1/s1
InChIKey FQXXSQDCDRQNQE-VMDGZTHMSA-N
Melting Point 193C
Molecular Weight 311.381012
Synonyms IMINOETHANOPHENANTHRO/4,5-BCD/- FURAN, 4AH-8,9C-, 8,9-DIHYDRO-3,5- DIMETHOXY-12-METHYL-, THEBAINE
Technique KBr WAFER