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Tricyclo[3.3.1.1(3,7)]decane-1,3-dicarboxylic acid, 4-oxo-, dibutyl ester
SpectraBase Compound ID Ir6UB6wWeE5
InChI InChI=1S/C20H30O5/c1-3-5-7-24-17(22)19-10-14-9-15(12-19)16(21)20(11-14,13-19)18(23)25-8-6-4-2/h14-15H,3-13H2,1-2H3/t14-,15+,19+,20?/m1/s1
InChIKey ITWWVVLMKHMWAM-BQRQEFCASA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PAMrRwFgu0
Name Tricyclo[3.3.1.1(3,7)]decane-1,3-dicarboxylic acid, 4-oxo-, dibutyl ester
CAS Registry Number 55724-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-3-5-7-24-17(22)19-10-14-9-15(12-19)16(21)20(11-14,13-19)18(23)25-8-6-4-2/h14-15H,3-13H2,1-2H3/t14-,15+,19+,20?/m1/s1
InChIKey ITWWVVLMKHMWAM-BQRQEFCASA-N
Molecular Weight 350.455 g/mol
SMILES C12(C([C@]3(C[C@](C[C@](C2)(C(=O)OCCCC)C3)(C1)[H])[H])=O)C(=O)OCCCC
SPLASH splash10-004l-9880000000-e64baca5691af1c15290
Source of Spectrum SD-1981-0-0
Synonyms dibutyl 4-oxo-1,3-adamantanedicarboxylate
Wiley ID 1341997