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6-(3-methoxyphenyl)-2-phenyl-(1^13C)cyclohexa-1,3,5-trien-1-ol
SpectraBase Compound ID F664VG72By6
InChI InChI=1S/C19H16O2/c1-21-16-10-5-9-15(13-16)18-12-6-11-17(19(18)20)14-7-3-2-4-8-14/h2-13,20H,1H3/i19+1
InChIKey BPESIRVJQLVGBI-QHPTYGIKSA-N
Mol Weight 277.33 g/mol
Molecular Formula C1813CH16O2
Exact Mass 277.118385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zuWjw3StgG
Name 6-(3-methoxyphenyl)-2-phenyl-(1^13C)cyclohexa-1,3,5-trien-1-ol
Appearance Yellow oil
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Exact Mass 277.118384588 u
Formula C18[13C]H16O2
InChI InChI=1S/C19H16O2/c1-21-16-10-5-9-15(13-16)18-12-6-11-17(19(18)20)14-7-3-2-4-8-14/h2-13,20H,1H3/i19+1
InChIKey BPESIRVJQLVGBI-QHPTYGIKSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201808388
Molecular Weight 277.327 g/mol
Quality 813
SMILES O[13C]=1C(=CC=CC1C1=CC=CC=C1)C1=CC(=CC=C1)OC
SPLASH splash10-004i-0290000000-a9e04f216565a5b88d5a
Source of Spectrum ACI-57-SM16-3f-C-13 (DOI: 10.1002/anie.201808388)
Wiley ID 1893473