| SpectraBase Spectrum ID |
JhlEryu9Z4C |
| Name |
(1S,8R,8aR) 4-oxo-8-phenyl-3,4,8,8a-tetrahydro-1H-isochromen-1-yl 4-chlorobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H17ClO4 |
| InChI |
InChI=1S/C22H17ClO4/c23-16-11-9-15(10-12-16)21(25)27-22-20-17(14-5-2-1-3-6-14)7-4-8-18(20)19(24)13-26-22/h1-12,17,20,22H,13H2/t17-,20+,22-/m0/s1 |
| InChIKey |
ZPHDMJNMWVDSOK-WEYGHZABSA-N |
| Molecular Weight |
380.827 g/mol |
| SMILES |
C=1C=C2C(CO[C@]([C@]2([H])[C@@](C1)(c1ccccc1)[H])(OC(=O)c1ccc(cc1)Cl)[H])=O |
| SPLASH |
splash10-014i-1930000000-0c74961a2716fbe7a8a9 |
| Source of Spectrum |
A1-14-3740/SMS12-4t |
| Synonyms |
(1S,8R,8aR)-4-oxo-8-phenyl-3,4,8,8a-tetrahydro-1H-isochromen-1-yl 4-chlorobenzoate |
| Wiley ID |
1750442 |
