| SpectraBase Spectrum ID |
5Njp342AW0X |
| Name |
piceatannol, 3TMS |
| Alternate Name(s) |
KBioGR_000460, 3TMS
KBioSS_000460, 3TMS
KBio2_000460, 3TMS
KBio2_003028, 3TMS
KBio2_005596, 3TMS
5-[2-(3,4-dihydroxyphenyl)ethenyl]benzene-1,3-diol, 3TMS
(E)-4-(3,5-dihydroxystyryl)benzene-1,2-diol |
| Comments |
Non-derivatized structure shown; Derivatization type: 3 TMS (mass: 460.192); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000812; Note: The molecular formula of the structure shown is C14H12O4 - which differs from the formula reported for the mass spectrum (C23H36O4Si3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H36O4Si3 |
| InChI |
InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+ |
| InChIKey |
CDRPUGZCRXZLFL-OWOJBTEDSA-N |
| Molecular Weight |
244.246 g/mol |
| SMILES |
Oc1cc(cc(\C=C\c2ccc(c(c2)O)O)c1)O |
| SPLASH |
splash10-000t-0942100000-cdb83f47646dd86d2035 |
| Source of Spectrum |
FM-2019-812-0 |
| Wiley ID |
1818486 |
