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1,2-pyrenedicarboxylic acid
SpectraBase Compound ID CtZgsEd22Vg
InChI InChI=1S/C18H10O4/c19-17(20)13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)18(21)22/h1-8H,(H,19,20)(H,21,22)
InChIKey VPFNQPKIUJJSEN-UHFFFAOYSA-N
Mol Weight 290.27 g/mol
Molecular Formula C18H10O4
Exact Mass 290.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQzkYxlWKXT
Name 1,2-pyrenedicarboxylic acid
CAS Registry Number 50472-52-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H10O4
InChI InChI=1S/C18H10O4/c19-17(20)13-8-11-5-4-9-2-1-3-10-6-7-12(15(11)14(9)10)16(13)18(21)22/h1-8H,(H,19,20)(H,21,22)
InChIKey VPFNQPKIUJJSEN-UHFFFAOYSA-N
Molecular Weight 290.274 g/mol
SMILES OC(c1c2c3c(cc1C(O)=O)ccc1c3c(cc2)ccc1)=O
SPLASH splash10-0udi-0090000000-da4f33f35a726900e611
Source of Spectrum J-55-2163-18
Synonyms Pyrene-1,2-dicarboxylic acid
Wiley ID 1293820