| SpectraBase Spectrum ID |
1G3oVLJLYnw |
| Name |
Elemicin-M isomer-1 3AC |
| Classification |
Ingredient of
nutmeg |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
354.131467660 u |
| Formula |
C17H22O8 |
| InChI |
InChI=1S/C17H22O8/c1-10(18)23-9-14(24-11(2)19)6-13-7-15(21-4)17(22-5)16(8-13)25-12(3)20/h7-8,14H,6,9H2,1-5H3 |
| InChIKey |
UPWSUNIGQFXPIB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
354.355 g/mol |
| SMILES |
c1(cc(CC(COC(C)=O)OC(C)=O)cc(OC)c1OC)OC(C)=O |
| SPLASH |
splash10-0udi-0690000000-7311de5c1386980682ec |
| 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 |
| Synonyms |
Elemicin-M (demethyl-dihydroxy-) isomer-1 3AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_7138 |
