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10-Oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene-6-carboxylic acid, 3-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-
SpectraBase Compound ID DsyHJnXCNr8
InChI InChI=1S/C16H13ClFNO4/c17-9-2-1-3-10(18)8(9)6-19-7-16-5-4-11(23-16)12(15(21)22)13(16)14(19)20/h1-5,11-13H,6-7H2,(H,21,22)/t11-,12-,13+,16-/m0/s1
InChIKey SOIQCTCZLBBALQ-JFILPPLUSA-N
Mol Weight 337.73 g/mol
Molecular Formula C16H13ClFNO4
Exact Mass 337.051714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QGwPLoSrqY
Name 10-Oxa-3-azatricyclo[5.2.1.0(1,5)]dec-8-ene-6-carboxylic acid, 3-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClFNO4
InChI InChI=1S/C16H13ClFNO4/c17-9-2-1-3-10(18)8(9)6-19-7-16-5-4-11(23-16)12(15(21)22)13(16)14(19)20/h1-5,11-13H,6-7H2,(H,21,22)/t11-,12-,13+,16-/m0/s1
InChIKey SOIQCTCZLBBALQ-JFILPPLUSA-N
Molecular Weight 337.734 g/mol
SMILES OC([C@]1([C@]2(O[C@@]3([C@]1(C(N(C3)Cc1c(cccc1F)Cl)=O)[H])C=C2)[H])[H])=O
SPLASH splash10-0f7n-9300000000-91ff50b8364e767bdec7
Source of Spectrum IY-1-4535-9
Wiley ID 1653342