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Bicyclo[4.1.0]hepta-2,4-diene-7-carboxylic acid, 1,2,3,7-tetramethyl-, methyl ester, (1.alpha.,6.alpha.,7.alpha.)-
SpectraBase Compound ID B2ALy5JKZMV
InChI InChI=1S/C13H18O2/c1-8-6-7-10-12(3,9(8)2)13(10,4)11(14)15-5/h6-7,10H,1-5H3/t10-,12+,13-/m1/s1
InChIKey UJNPDAPQGILJHX-KGYLQXTDSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EofIivGylZv
Name Bicyclo[4.1.0]hepta-2,4-diene-7-carboxylic acid, 1,2,3,7-tetramethyl-, methyl ester, (1.alpha.,6.alpha.,7.alpha.)-
Alternate Name(s) Methyl (1R,6R,7S)-1,2,3,7-tetramethylbicyclo[4.1.0]hepta-2,4-diene-7-carboxylate Methyl ester of 1,2,3,7-tetramethyl-norcaradien-7-carbonic acid
CAS Registry Number 62528-66-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-8-6-7-10-12(3,9(8)2)13(10,4)11(14)15-5/h6-7,10H,1-5H3/t10-,12+,13-/m1/s1
InChIKey UJNPDAPQGILJHX-KGYLQXTDSA-N
Molecular Weight 206.285 g/mol
SMILES [C@@]12([C@](C(=O)OC)(C)[C@@]2(C=CC(=C1C)C)[H])C
SPLASH splash10-0002-0900000000-bf88792a82c429810f44
Source of Spectrum H-59-1791-20
Wiley ID 1204682