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Phenolphthalein 2AC
SpectraBase Compound ID F1SXfuPlLqO
InChI InChI=1S/C24H18O6/c1-15(25)28-19-11-7-17(8-12-19)24(18-9-13-20(14-10-18)29-16(2)26)22-6-4-3-5-21(22)23(27)30-24/h3-14H,1-2H3
InChIKey UQJULZIHROYMOK-UHFFFAOYSA-N
Mol Weight 402.4 g/mol
Molecular Formula C24H18O6
Exact Mass 402.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1AVNa9PQbeJ
Name Phenolphthalein 2AC
Classification Laxative
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Exact Mass 402.110338294 u
Formula C24H18O6
InChI InChI=1S/C24H18O6/c1-15(25)28-19-11-7-17(8-12-19)24(18-9-13-20(14-10-18)29-16(2)26)22-6-4-3-5-21(22)23(27)30-24/h3-14H,1-2H3
InChIKey UQJULZIHROYMOK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 402.402 g/mol
Related CAS Registry Number(s) 77-09-8
SMILES C1(c2ccccc2C(O1)=O)(c1ccc(OC(C)=O)cc1)c1ccc(cc1)OC(C)=O
SPLASH splash10-02mi-1489000000-5f4f386c3e206b0b7b15
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3077