SpectraBase Spectrum ID |
Domq4TKoaQK |
Name |
Asarinin |
CAS Registry Number |
133-03-9 |
Classification |
Pharmaceutical drug intermediate |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
354.110338294 u |
Formula |
C20H18O6 |
InChI |
InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2 |
InChIKey |
PEYUIKBAABKQKQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
354.358 g/mol |
Nominal Mass |
354 u |
Quality |
921 |
Retention Index |
3073 |
SMILES |
C12C(C(C3=CC4=C(C=C3)OCO4)OC2)COC1C=1C=C2C(=CC1)OCO2 |
SPLASH |
splash10-0002-4910000000-bf8db7b0ffbbb1bd07ec |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3aa',4,6,6aa'-Tetrahydro-1a',4a'-bis[3,4-(methylenedioxy)phenyl]-(+)-1H,3H-furo[3,4-c]furan |
Technique |
GC/MS |
Wiley ID |
DD2024_008316 |