| SpectraBase Spectrum ID |
KeZQ3KCWFQ2 |
| Name |
Methyl ester of decahydro-2,6,6,9a-tetramethyl-1-benzoxepin-3-carboxylic acid |
| CAS Registry Number |
77984-85-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H28O3 |
| InChI |
InChI=1S/C16H28O3/c1-11-12(14(17)18-5)7-8-13-15(2,3)9-6-10-16(13,4)19-11/h11-13H,6-10H2,1-5H3 |
| InChIKey |
ZVLGLEZJSSQZDS-UHFFFAOYSA-N |
| Molecular Weight |
268.397 g/mol |
| SMILES |
C12(OC(C(C(=O)OC)CCC2C(C)(C)CCC1)C)C |
| SPLASH |
splash10-059x-9500000000-bd805f563717c7d6f0fd |
| Source of Spectrum |
J-46-3552-0 |
| Synonyms |
Methyl 2,6,6,9a-tetramethyldecahydro-1-benzoxepin-3-carboxylate |
| Wiley ID |
1272401 |
