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Phosphoric acid, triheptyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Phosphoric acid, triheptyl ester
SpectraBase Compound ID yiaUpm9QJ8
InChI InChI=1S/C21H45O4P/c1-4-7-10-13-16-19-23-26(22,24-20-17-14-11-8-5-2)25-21-18-15-12-9-6-3/h4-21H2,1-3H3
InChIKey GSURLQOINUQIIH-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C21H45O4P
Exact Mass 392.305547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LaaHGhBaJyN
Name Phosphoric acid, triheptyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H45O4P
InChI InChI=1S/C21H45O4P/c1-4-7-10-13-16-19-23-26(22,24-20-17-14-11-8-5-2)25-21-18-15-12-9-6-3/h4-21H2,1-3H3
InChIKey GSURLQOINUQIIH-UHFFFAOYSA-N
Molecular Weight 392.561 g/mol
SMILES CCCCCCCOP(OCCCCCCC)(OCCCCCCC)=O
SPLASH splash10-0002-9110000000-06f156647da68e5c2215
Source of Spectrum NP-14-2601-0
Synonyms Triheptyl phosphate
Wiley ID 1111640