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Phenolphthalein 2TFA
SpectraBase Compound ID 4v2hnEguyPG
InChI InChI=1S/C24H12F6O6/c25-23(26,27)20(32)34-15-9-5-13(6-10-15)22(18-4-2-1-3-17(18)19(31)36-22)14-7-11-16(12-8-14)35-21(33)24(28,29)30/h1-12H
InChIKey TWMRLICYCMLKRJ-UHFFFAOYSA-N
Mol Weight 510.34 g/mol
Molecular Formula C24H12F6O6
Exact Mass 510.053807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGTSyyF5ajg
Name Phenolphthalein 2TFA
Classification pH-indicator derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 510.053807078 u
Formula C24H12F6O6
InChI InChI=1S/C24H12F6O6/c25-23(26,27)20(32)34-15-9-5-13(6-10-15)22(18-4-2-1-3-17(18)19(31)36-22)14-7-11-16(12-8-14)35-21(33)24(28,29)30/h1-12H
InChIKey TWMRLICYCMLKRJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 510.344 g/mol
Nominal Mass 510 u
Quality 941
Retention Index 3740
SMILES C1(C=2C(C(O1)=O)=CC=CC2)(C=1C=CC(=CC1)OC(C(F)(F)F)=O)C=1C=CC(=CC1)OC(C(F)(F)F)=O
SPLASH splash10-0fk9-1349000000-30319e5b31138890bffa
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(3-oxo-1-(4-((trifluoroacetyl)oxy)phenyl)-1,3-dihydro-2-benzofuran-1-yl)phenyl trifluoroacetate
Technique GC/MS
Wiley ID DD2024_015180