| SpectraBase Spectrum ID |
KvBQ5JH4Ro |
| Name |
Thebaol |
| CAS Registry Number |
481-81-2 |
| Classification |
Ingredient of
opium |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
254.094294308 u |
| Formula |
C16H14O3 |
| InChI |
InChI=1S/C16H14O3/c1-18-12-7-5-10-3-4-11-6-8-14(19-2)16(17)15(11)13(10)9-12/h3-9,17H,1-2H3 |
| InChIKey |
GKDSKCYMUUXQLA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
254.285 g/mol |
| SMILES |
c12c(cc(cc2)OC)c2c(O)c(ccc2cc1)OC |
| SPLASH |
splash10-0udr-1390000000-bcf5ce1bbf6cad84122f |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_2328 |
