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2,13-Dioxabicyclo[12.2.2]octadeca-14,16,17-triene-15,18-dicarboxylic acid
SpectraBase Compound ID A5fkwHvvepY
InChI InChI=1S/C18H24O6/c19-17(20)14-11-13-12-15(18(21)22)16(14)24-10-8-6-4-2-1-3-5-7-9-23-13/h11-12H,1-10H2,(H,19,20)(H,21,22)
InChIKey MHSDIMUIOUBRML-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C18H24O6
Exact Mass 336.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDS8XvNoG46
Name 2,13-Dioxabicyclo[12.2.2]octadeca-1(16),14,17-triene-15,18-dicarboxylic acid
CAS Registry Number 39622-69-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O6
InChI InChI=1S/C18H24O6/c19-17(20)14-11-13-12-15(18(21)22)16(14)24-10-8-6-4-2-1-3-5-7-9-23-13/h11-12H,1-10H2,(H,19,20)(H,21,22)
InChIKey MHSDIMUIOUBRML-UHFFFAOYSA-N
Molecular Weight 336.384 g/mol
SMILES OC(c1cc2cc(C(=O)O)c1OCCCCCCCCCCO2)=O
SPLASH splash10-053f-9500000000-f3ed08367bf21f60f1cc
Synonyms 2,13-dioxabicyclo[12.2.2]octadeca-1(17),14(18),15-triene-15,18-dicarboxylic acid 2,13-Dioxabicyclo[12.2.2]octadeca-14,16,17-triene-15,18-dicarboxylic acid
Wiley ID 1486644