SpectraBase Spectrum ID |
2fjPpTap9CU |
Name |
Etafenone-M (HO-) isomer-2 |
Classification |
Coronary dilator |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
341.199093730 u |
Formula |
C21H27NO3 |
InChI |
InChI=1S/C21H27NO3/c1-3-22(4-2)14-15-25-21-11-6-5-10-19(21)20(24)13-12-17-8-7-9-18(23)16-17/h5-11,16,23H,3-4,12-15H2,1-2H3 |
InChIKey |
CHIPPEYYEMMVMU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
341.451 g/mol |
SMILES |
c1cc(C(=O)CCc2cccc(c2)O)c(OCCN(CC)CC)cc1 |
SPLASH |
splash10-000i-9100000000-c15054be1519bb1c141b |
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: UHY |
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_3348 |