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1-Monopalmitoylglycerol 2TFA
SpectraBase Compound ID 2989jprEpfu
InChI InChI=1S/C23H36F6O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(30)33-16-18(35-21(32)23(27,28)29)17-34-20(31)22(24,25)26/h18H,2-17H2,1H3
InChIKey TZAJHBZZPGJVBN-UHFFFAOYSA-N
Mol Weight 522.5 g/mol
Molecular Formula C23H36F6O6
Exact Mass 522.241608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GKhnGD6s7M
Name 1-Monopalmitoylglycerol 2TFA
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 522.241607851 u
Formula C23H36F6O6
InChI InChI=1S/C23H36F6O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(30)33-16-18(35-21(32)23(27,28)29)17-34-20(31)22(24,25)26/h18H,2-17H2,1H3
InChIKey TZAJHBZZPGJVBN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 522.525 g/mol
Nominal Mass 522 u
Quality 978
Retention Index 3608
SMILES C(C(OC(COC(C(F)(F)F)=O)COC(CCCCCCCCCCCCCCC)=O)=O)(F)(F)F
SPLASH splash10-014i-9270000000-d4326c9c5943a3fc91f5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2,3-Bis((trifluoroacetyl)oxy)propyl hexadecanoate
Technique GC/MS
Wiley ID DD2024_030818