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Dimethyl 8-(t-butyl)-1,6,10-trimethyl-3-deuterioheptalene-4,5-dicarboxylate
SpectraBase Compound ID AvXCLHE7buC
InChI InChI=1S/C23H28O4/c1-13-9-10-17(21(24)26-7)20(22(25)27-8)19-15(3)12-16(23(4,5)6)11-14(2)18(13)19/h9-12H,1-8H3/i10D
InChIKey LKOAMBUFXYHGED-MMIHMFRQSA-N
Mol Weight 369.48 g/mol
Molecular Formula C23H272DO4
Exact Mass 369.205036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dyD27wHOGG
Name Dimethyl 8-(t-butyl)-1,6,10-trimethyl-3-deuterioheptalene-4,5-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27DO4
InChI InChI=1S/C23H28O4/c1-13-9-10-17(21(24)26-7)20(22(25)27-8)19-15(3)12-16(23(4,5)6)11-14(2)18(13)19/h9-12H,1-8H3/i10D
InChIKey LKOAMBUFXYHGED-MMIHMFRQSA-N
Molecular Weight 369.479 g/mol
SMILES C=1(C=C(C(=C(C2=C(C=C(C=C(C12)C)C(C)(C)C)C)C(=O)OC)C(=O)OC)[2D])C
SPLASH splash10-01di-0089000000-efde209c1dfdfdbca7ce
Source of Spectrum H-85-52-2
Wiley ID 1525191