SpectraBase Spectrum ID |
KO7DnQyM9xZ |
Name |
4a(2H)-Naphthalenecarboxylic acid, 1,3,4,5,8,8a-hexahydro-1-(1-methylethylidene)-4-oxo-, ethyl ester, (4aR-cis)- |
CAS Registry Number |
96246-17-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H22O3 |
InChI |
InChI=1S/C16H22O3/c1-4-19-15(18)16-10-6-5-7-13(16)12(11(2)3)8-9-14(16)17/h5-6,13H,4,7-10H2,1-3H3/t13-,16+/m0/s1 |
InChIKey |
IZCMPLMKKSAQCM-XJKSGUPXSA-N |
Molecular Weight |
262.349 g/mol |
SMILES |
[C@]12([C@](C(=C(C)C)CCC2=O)(CC=CC1)[H])C(=O)OCC |
SPLASH |
splash10-0fb9-9600000000-dedc492010a0e0c18319 |
Source of Spectrum |
J-50-1909-10 |
Synonyms |
(4R,9R,10S)-(+)-9-(ethoxycarbonyl)-4-(2-propenyl)-cis-.delta.(6)-1-octalone
Ethyl (4aR,8aS)-1-(1-methylethylidene)-4-oxo-1,3,4,5,8,8a-hexahydro-4a(2H)-naphthalenecarboxylate |
Wiley ID |
1266141 |