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Tricyclo[5.2.1.0(2,6)]decane-4,8-dicarboxylic acid

View entire compound with spectra: 1 FTIR

Tricyclo[5.2.1.0(2,6)]decane-4,8-dicarboxylic acid
SpectraBase Compound ID 3TfAyUV8aUX
InChI InChI=1S/C12H16O4/c13-11(14)6-3-7-5-1-9(8(7)4-6)10(2-5)12(15)16/h5-10H,1-4H2,(H,13,14)(H,15,16)/t5-,6?,7?,8?,9-,10-/m0/s1
InChIKey RKLMSTQEVORNHJ-NCTCKMGRSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GH0FfqWuq93
Name Tricyclo[5.2.1.0(2,6)]decane-4,8-dicarboxylic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.104858991 u
Formula C12H16O4
InChI InChI=1S/C12H16O4/c13-11(14)6-3-7-5-1-9(8(7)4-6)10(2-5)12(15)16/h5-10H,1-4H2,(H,13,14)(H,15,16)/t5-,6?,7?,8?,9-,10-/m0/s1
InChIKey RKLMSTQEVORNHJ-NCTCKMGRSA-N
Molecular Weight 224.256 g/mol
SMILES C12[C@]3([C@@](C(=O)O)(C[C@@](C2CC(C1)C(=O)O)(C3)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96348