| SpectraBase Spectrum ID |
CTF4woRi3fx |
| Name |
(3a.alpha.,7a.beta)-5-(2',3',4'-trimethoxyphenyl)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole |
| CAS Registry Number |
116211-64-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O5 |
| InChI |
InChI=1S/C18H24O5/c1-18(2)22-13-8-6-11(10-15(13)23-18)12-7-9-14(19-3)17(21-5)16(12)20-4/h7,9-10,13,15H,6,8H2,1-5H3/t13-,15-/m1/s1 |
| InChIKey |
VYQHDMWDJBVKPZ-UKRRQHHQSA-N |
| Molecular Weight |
320.385 g/mol |
| SMILES |
C1(c2c(c(OC)c(cc2)OC)OC)=C[C@]2(OC(C)(C)O[C@@]2(CC1)[H])[H] |
| SPLASH |
splash10-001i-0093000000-296eb940724974bfafbc |
| Source of Spectrum |
J-53-4950-13 |
| Synonyms |
(3aR,7aR)-2,2-dimethyl-6-(2,3,4-trimethoxyphenyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxole |
| Wiley ID |
1320136 |
