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Di-tert-butylphenyl phenyl phosphate
SpectraBase Compound ID 3gl4QQnKVmO
InChI InChI=1S/C26H31O4P/c1-25(2,3)21-16-10-12-18-23(21)29-31(27,28-20-14-8-7-9-15-20)30-24-19-13-11-17-22(24)26(4,5)6/h7-19H,1-6H3
InChIKey UQRSMZHDWDMLDH-UHFFFAOYSA-N
Mol Weight 438.5 g/mol
Molecular Formula C26H31O4P
Exact Mass 438.195996 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oldYcvq4BM
Name Di-tert-butylphenyl phenyl phosphate
CAS Registry Number 65652-41-7
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 438.195996472 u
Formula C26H31O4P
InChI InChI=1S/C26H31O4P/c1-25(2,3)21-16-10-12-18-23(21)29-31(27,28-20-14-8-7-9-15-20)30-24-19-13-11-17-22(24)26(4,5)6/h7-19H,1-6H3
InChIKey UQRSMZHDWDMLDH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 438.504 g/mol
Nominal Mass 438 u
Quality 936
Retention Index 3200
SMILES C1(=C(OP(OC=2C(C(C)(C)C)=CC=CC2)(OC2=CC=CC=C2)=O)C=CC=C1)C(C)(C)C
SPLASH splash10-00di-6530900000-74c72dc37c8fed8cc404
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Phosphoricacid,bis[(1,1-dimethylethyl)phenyl] phenyl ester
Technique GC/MS
Wiley ID DD2024_026886