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Methyl 3-[12'-ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene]-[1-(13C)]-prop-2-enoate
SpectraBase Compound ID 5epYxgjYvjH
InChI InChI=1S/C22H18O2/c1-3-14-19(12-13-20(23)24-2)22-17-10-6-4-8-15(17)21(14)16-9-5-7-11-18(16)22/h3-11,13-14,21-22H,1H2,2H3/t12?,14-,21-,22+/m0/s1/i20+1
InChIKey GWIQSPQQEVZYTJ-ARULEVHBSA-N
Mol Weight 315.38 g/mol
Molecular Formula C2113CH18O2
Exact Mass 315.134035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrjBOwMoZ6n
Name Methyl 3-[12'-ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene]-[1-(13C)]-prop-2-enoate
Alternate Name(s) Methyl 3-(12'-ethenyl-9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene)-[1-¹³C]prop-2-enoate
Comments Original formula: C21[13C]H18O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18O2
InChI InChI=1S/C22H18O2/c1-3-14-19(12-13-20(23)24-2)22-17-10-6-4-8-15(17)21(14)16-9-5-7-11-18(16)22/h3-11,13-14,21-22H,1H2,2H3/t12?,14-,21-,22+/m0/s1/i20+1
InChIKey GWIQSPQQEVZYTJ-ARULEVHBSA-N
Molecular Weight 315.376 g/mol
SMILES C1([C@]2(c3ccccc3[C@@]([C@]1(C=C)[H])(c1ccccc21)[H])[H])=C=C[13C](=O)OC
SPLASH splash10-056r-0940000000-54dd0bb097929b3d5f56
Source of Spectrum B-52-671-0
Wiley ID 746495