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1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-oxo-, [1S-(1.alpha.,4a.alpha.,8a.beta.)]-
SpectraBase Compound ID 5KfLwqrls0B
InChI InChI=1S/C13H20O3/c1-12-6-3-7-13(2,11(15)16)10(12)5-4-9(14)8-12/h10H,3-8H2,1-2H3,(H,15,16)/t10?,12-,13+/m1/s1
InChIKey NWCJTZQLFXGORW-SOYIIFOFSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jwt3IkjLj5K
Name 1-Naphthalenecarboxylic acid, decahydro-1,4a-dimethyl-6-oxo-, [1S-(1.alpha.,4a.alpha.,8a.beta.)]-
Alternate Name(s) (1S,4aR)-1,4a-dimethyl-6-oxodecahydro-1-naphthalenecarboxylic acid (1S,4aR)-Perhydro-1,4a-dimethyl-6-oxonaphthalene-1-carboxylic acid
CAS Registry Number 126641-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-12-6-3-7-13(2,11(15)16)10(12)5-4-9(14)8-12/h10H,3-8H2,1-2H3,(H,15,16)/t10?,12-,13+/m1/s1
InChIKey NWCJTZQLFXGORW-SOYIIFOFSA-N
Molecular Weight 224.300 g/mol
SMILES OC([C@@]1(C2[C@](CC(CC2)=O)(C)CCC1)C)=O
SPLASH splash10-0aba-9800000000-14b0b6f7493422ac2913
Source of Spectrum H-72-1395-0
Wiley ID 1225303