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2,2-bis(Hydroxymethyl)propane-1,3-diyl-bis(2'-hydroxybenzoate)
SpectraBase Compound ID 2jON79SLPxI
InChI InChI=1S/C19H20O8/c20-9-19(10-21,11-26-17(24)13-5-1-3-7-15(13)22)12-27-18(25)14-6-2-4-8-16(14)23/h1-8,20-23H,9-12H2
InChIKey OXVUWBSETCTPTL-UHFFFAOYSA-N
Mol Weight 376.36 g/mol
Molecular Formula C19H20O8
Exact Mass 376.115818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jvLfSzwqpN
Name 2,2-bis(Hydroxymethyl)propane-1,3-diyl-bis(2'-hydroxybenzoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O8
InChI InChI=1S/C19H20O8/c20-9-19(10-21,11-26-17(24)13-5-1-3-7-15(13)22)12-27-18(25)14-6-2-4-8-16(14)23/h1-8,20-23H,9-12H2
InChIKey OXVUWBSETCTPTL-UHFFFAOYSA-N
Molecular Weight 376.361 g/mol
SMILES Oc1c(C(OCC(CO)(COC(c2c(O)cccc2)=O)CO)=O)cccc1
SPLASH splash10-004i-0019000000-5021f814bff681b01087
Source of Spectrum Y5-65-684-4
Synonyms 2',2'-bis(Hydroxymethyl)propane-1,2-diyl bis(2'-hydroxybenzoate) 3-Hydroxy-2-{[(2-hydroxybenzoyl)oxy]methyl}-2-(hydroxymethyl)propyl salicylate
Wiley ID 1546309