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Bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene-11-d-11-carboxylic acid, methyl ester
SpectraBase Compound ID 57IhaUL0s9K
InChI InChI=1S/C13H12O2/c1-15-13(14)12-10-6-2-3-7-11(12)9-5-4-8-10/h2-9,12H,1H3/i12D
InChIKey WDXWYGHRZVRCHQ-UQBWLURTSA-N
Mol Weight 201.24 g/mol
Molecular Formula C13H112DO2
Exact Mass 201.090006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92MPaB4t7aP
Name Bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene-11-d-11-carboxylic acid, methyl ester
CAS Registry Number 121610-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11DO2
InChI InChI=1S/C13H12O2/c1-15-13(14)12-10-6-2-3-7-11(12)9-5-4-8-10/h2-9,12H,1H3/i12D
InChIKey WDXWYGHRZVRCHQ-UQBWLURTSA-N
Molecular Weight 201.243 g/mol
SMILES C1(C=2C=CC=CC1=CC=CC2)(C(=O)OC)[2D]
SPLASH splash10-00kf-0900000000-70ac08f00c675caff4bf
Source of Spectrum H-71-1936-16
Synonyms Methyl (11-deuterio)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene-11-carboxylate
Wiley ID 1198194