| SpectraBase Spectrum ID |
LcSHNRCZ71J |
| Name |
Methadone intermediate-3 artifact |
| CAS Registry Number |
13957-55-6 |
| Classification |
Potent analgesic |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
253.183049745 u |
| Formula |
C18H23N |
| InChI |
InChI=1S/C18H23N/c1-15(19(2)3)14-18(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,18H,14H2,1-3H3 |
| InChIKey |
NSHMKXVHJBBKTN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
253.389 g/mol |
| SMILES |
C(C(c1ccccc1)c1ccccc1)C(N(C)C)C |
| SPLASH |
splash10-00di-9200000000-7f88c9431fdfaab04d75 |
| 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_2837 |
