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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

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID HPlWTJiujgr
Name Thebaine
Source of Sample Alltech Associates, Inc., Grace Davison Discovery Sciences
Catalog Number 01807
Lot Number 491
Accessory DurasamplIR II
CAS Registry Number 115-37-7
Classification Opium and Opiate
Code of Federal Regulations 21 CFR Section 1308.12 (b) (1) (xvii)
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
DEA Controlled Substances Code Number 9333
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
Instrument Name Bio-Rad FTS
Source of Spectrum Forensic Spectral Research
Synonyms PARAMORPHINE; Morphinan, 6,7,8,14-tetradehydro-4,5-alpha-epoxy-3,6-dimethoxy-17-methyl-
Technique ATR-Neat (DuraSamplIR II)