| SpectraBase Spectrum ID |
LlLT4fz7yuX |
| Name |
Benzoic acid, 2-hydroxy-5-(2-propynyloxy)-, 1,7-heptanediyl ester |
| Alternate Name(s) |
1,7-Heptanediyl bis[2-hydroxy-5-(2-propynyloxy)benzoate
7-{[2-hydroxy-5-(2-propynyloxy)benzoyl]oxy}heptyl 2-hydroxy-5-(2-propynyloxy)benzoate |
| CAS Registry Number |
120296-69-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H28O8 |
| InChI |
InChI=1S/C27H28O8/c1-3-14-32-20-10-12-24(28)22(18-20)26(30)34-16-8-6-5-7-9-17-35-27(31)23-19-21(33-15-4-2)11-13-25(23)29/h1-2,10-13,18-19,28-29H,5-9,14-17H2 |
| InChIKey |
JLHRMXCRQOMPTD-UHFFFAOYSA-N |
| Molecular Weight |
480.513 g/mol |
| SMILES |
Oc1c(C(OCCCCCCCOC(c2c(ccc(c2)OCC#C)O)=O)=O)cc(cc1)OCC#C |
| SPLASH |
splash10-000i-0900100000-139b5d14a04b57a632f8 |
| Source of Spectrum |
C-111-3647-8 |
| Wiley ID |
1395217 |
