| SpectraBase Spectrum ID |
2AYStvsgoy |
| Name |
Hexamid-M (deethyl-HO-) 2AC |
| Classification |
Anesthetic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
403.174335531 u |
| Formula |
C20H25N3O6 |
| InChI |
InChI=1S/C20H25N3O6/c1-5-20(15-7-9-16(10-8-15)29-14(4)25)17(26)21-19(28)23(18(20)27)12-11-22(6-2)13(3)24/h7-10H,5-6,11-12H2,1-4H3,(H,21,26,28) |
| InChIKey |
CTROTMMKMUOVAM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
403.435 g/mol |
| SMILES |
c1cc(ccc1OC(=O)C)C1(C(N(CCN(C(C)=O)CC)C(=O)NC1=O)=O)CC |
| SPLASH |
splash10-08fr-9615000000-bdd6bd9a93180fa4d968 |
| 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. |
| Sample Preparation Procedure |
Detected: U+UHYAC |
| 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_1911 |
