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2-(4B,8,8,10A-Tetramethyl-2-methylenetetradecahydrophenanthren-1-yl)acetic acid, me derivative

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2-(4B,8,8,10A-Tetramethyl-2-methylenetetradecahydrophenanthren-1-yl)acetic acid, me derivative
SpectraBase Compound ID 750HS82LfJO
InChI InChI=1S/C22H36O2/c1-15-8-9-18-21(4,16(15)14-19(23)24-6)13-10-17-20(2,3)11-7-12-22(17,18)5/h16-18H,1,7-14H2,2-6H3
InChIKey CCJLWBADNFUZPL-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C22H36O2
Exact Mass 332.27153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYYdB0B3nd6
Name 2-(4B,8,8,10A-Tetramethyl-2-methylenetetradecahydrophenanthren-1-yl)acetic acid, me derivative
Comments Computed using HOSE algorithm
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Exact Mass 332.271530397 u
Formula C22H36O2
InChI InChI=1S/C22H36O2/c1-15-8-9-18-21(4,16(15)14-19(23)24-6)13-10-17-20(2,3)11-7-12-22(17,18)5/h16-18H,1,7-14H2,2-6H3
InChIKey CCJLWBADNFUZPL-UHFFFAOYSA-N
Molecular Weight 332.528 g/mol
SMILES C(CC1C(CCC2C1(C)CCC1C2(CCCC1(C)C)C)=C)(=O)OC