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Tricyclo[4.4.0.0(2,5)]decane-2-carboxylic acid, 6,8,8-trimethyl-10-oxo-, methyl ester, (1.alpha.,2.beta.,5.beta.,6.alpha.)-(.+-.)-
SpectraBase Compound ID 7lEdteoWv90
InChI InChI=1S/C15H22O3/c1-13(2)7-9(16)11-14(3,8-13)10-5-6-15(10,11)12(17)18-4/h10-11H,5-8H2,1-4H3/t10-,11-,14-,15+/m0/s1
InChIKey JHNAOMKUTRISLN-LWWSYDQCSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fQEyvtiKh
Name Tricyclo[4.4.0.0(2,5)]decane-2-carboxylic acid, 6,8,8-trimethyl-10-oxo-, methyl ester, (1.alpha.,2.beta.,5.beta.,6.alpha.)-(.+-.)-
CAS Registry Number 67597-10-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-13(2)7-9(16)11-14(3,8-13)10-5-6-15(10,11)12(17)18-4/h10-11H,5-8H2,1-4H3/t10-,11-,14-,15+/m0/s1
InChIKey JHNAOMKUTRISLN-LWWSYDQCSA-N
Molecular Weight 250.338 g/mol
SMILES [C@@]12([C@]3(C(CC(C[C@]3([C@]2([H])CC1)C)(C)C)=O)[H])C(=O)OC
SPLASH splash10-053r-9400000000-0fbe04d02f8f0673e26e
Source of Spectrum C-101-7377-0
Synonyms 1,9,9-Trimethyl-5-carbmethoxytricyclo[4.4.0.0(2,5)]decan-7-one Methyl (1S,2R,5S,6S)-6,8,8-trimethyl-10-oxotricyclo[4.4.0.0(2,5)]decane-2-carboxylate
Wiley ID 1253606