| SpectraBase Spectrum ID |
GiqyPTDBkmC |
| Name |
Cocaine-D3 @ |
| Classification |
Local anesthetic
Addictive drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
306.165888394 u |
| Formula |
C17H18D3NO4 |
| InChI |
InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/i1D3 |
| InChIKey |
ZPUCINDJVBIVPJ-FIBGUPNXSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
306.376 g/mol |
| SMILES |
c1ccc(C(OC2CC3N(C(C2C(=O)OC)CC3)C([D])([D])[D])=O)cc1 |
| SPLASH |
splash10-000i-9611000000-9595c202ae5035ed5b42 |
| 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 |
| Synonyms |
Cocaine-M (benzoylecgonine)-D3 ME |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5565 |
