| SpectraBase Spectrum ID |
ynPK6xJnE |
| Name |
Rosmarinic acid |
| Appearance |
Colorless amorphous powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16O8 |
| InChI |
InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1 |
| InChIKey |
DOUMFZQKYFQNTF-WUTVXBCWSA-N |
| Instrument Name |
Finnigan MAT 12 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1016/j.jscs.2021.101324 |
| Molecular Weight |
360.318 g/mol |
| Optical Rotation |
[a]D22 =+81.7 (c = 0.8, MeOH) |
| Reported Formula |
C18H16O8 |
| SMILES |
Oc1c(cc(\C=C\C(O[C@](Cc2ccc(c(c2)O)O)(C(O)=O)[H])=O)cc1)O |
| SPLASH |
splash10-00b9-1910000000-18a9460765686acaaccb |
| Source of Spectrum |
SCS-25-SM5-9 |
| Wiley ID |
1879639 |
