SpectraBase Spectrum ID |
1af86tzaoC |
Name |
4,4,8,9a-Tetramethyl-9-[2'-(hydroxycarbonyl)ethyl]-perhydronaphthalen-7-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H28O3 |
InChI |
InChI=1S/C17H28O3/c1-11-12(6-7-15(19)20)17(4)9-5-8-16(2,3)14(17)10-13(11)18/h11-12,14H,5-10H2,1-4H3,(H,19,20)/t11-,12-,14-,17+/m0/s1 |
InChIKey |
BPXHQJBTPTZYKJ-MYLCLEHYSA-N |
Molecular Weight |
280.408 g/mol |
SMILES |
OC(CC[C@@]1([C@@]2([C@@](CC([C@]1(C)[H])=O)(C(C)(C)CCC2)[H])C)[H])=O |
SPLASH |
splash10-0abc-9820000000-c0dedfe39d8315a0973d |
Source of Spectrum |
Y4-84-216-9 |
Synonyms |
7-Oxo-14,15,16-trinor-labdane-13-oic Acid
3-[(1S,2S,4aS,8aR)-2,5,5,8a-tetramethyl-3-oxodecahydro-1-naphthalenyl]propanoic acid |
Wiley ID |
1550124 |