| SpectraBase Spectrum ID |
2xELdYGtO5A |
| Name |
3-[(E)-5-[2,5-bis(oxidanyl)phenyl]-3-methyl-pent-3-enyl]-2,4-dimethyl-5,6-bis(oxidanyl)benzaldehyde |
| Alternate Name(s) |
5-[(E)-5-(2,5-dihydroxyphenyl)-3-methyl-pent-3-enyl]-2,3-dihydroxy-4,6-dimethyl-benzaldehyde |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H24O5 |
| InChI |
InChI=1S/C21H24O5/c1-12(4-6-15-10-16(23)7-9-19(15)24)5-8-17-13(2)18(11-22)21(26)20(25)14(17)3/h4,7,9-11,23-26H,5-6,8H2,1-3H3/b12-4+ |
| InChIKey |
KTKUNEUPWDRROX-UUILKARUSA-N |
| Molecular Weight |
356.418 g/mol |
| SMILES |
Oc1c(c(c(c(CC\C(=C\Cc2c(ccc(c2)O)O)C)c1C)C)C=O)O |
| SPLASH |
splash10-004i-0901000000-32f0f28f4b8622762958 |
| Source of Spectrum |
X2-56-533-6 |
| Wiley ID |
1604827 |
