| SpectraBase Spectrum ID |
AUsOsBub6rL |
| Name |
1,2-Benzenediol, 5-methyl-3-(1,2,2-trimethylcyclopentyl)-, dibenzoate, (S)- |
| Alternate Name(s) |
1,2-Dibenzoyloxyherbertene
2-(benzoyloxy)-4-methyl-6-[(1S)-1,2,2-trimethylcyclopentyl]phenyl benzoate |
| CAS Registry Number |
103412-32-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H30O4 |
| InChI |
InChI=1S/C29H30O4/c1-20-18-23(29(4)17-11-16-28(29,2)3)25(33-27(31)22-14-9-6-10-15-22)24(19-20)32-26(30)21-12-7-5-8-13-21/h5-10,12-15,18-19H,11,16-17H2,1-4H3/t29-/m1/s1 |
| InChIKey |
WVXIYOGRPKTJJM-GDLZYMKVSA-N |
| Molecular Weight |
442.555 g/mol |
| SMILES |
c1(c(c(OC(=O)c2ccccc2)cc(c1)C)OC(=O)c1ccccc1)[C@@]1(C(CCC1)(C)C)C |
| SPLASH |
splash10-0a4i-0911000000-3933b1c4762207455a8a |
| Source of Spectrum |
KC-1986-708-24 |
| Wiley ID |
1385494 |
