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Dimethyl 1,5-(Ethylmethyl)semibullvalene-2,6-dicarboxylate
SpectraBase Compound ID 9bP1QsPlzIt
InChI InChI=1S/C15H18O4/c1-5-14-6-7-15(12(17)19-4)10(13(14,15)2)8-9(14)11(16)18-3/h6-8,10H,5H2,1-4H3/t10-,13-,14+,15-/m1/s1
InChIKey KXJFVQRDHOCVHF-QPKOPYBWSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRHYaob0XC1
Name Dimethyl 1,5-(Ethylmethyl)semibullvalene-2,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-5-14-6-7-15(12(17)19-4)10(13(14,15)2)8-9(14)11(16)18-3/h6-8,10H,5H2,1-4H3/t10-,13-,14+,15-/m1/s1
InChIKey KXJFVQRDHOCVHF-QPKOPYBWSA-N
Molecular Weight 262.305 g/mol
SMILES [C@]12([C@@]3(C=C[C@]2(C(C(=O)OC)=C[C@]13[H])CC)C(=O)OC)C
SPLASH splash10-0uec-0890000000-cf22f92ed42d22fd50fc
Source of Spectrum J-66-1960-3
Wiley ID 1534795