SpectraBase Compound ID | 6uaBFCH9gRh |
---|---|
InChI | InChI=1S/C18H12O2/c19-16(20)10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)18(13)17(11)12/h1-9H,10H2,(H,19,20) |
InChIKey | SDJCLYBBPUHKCD-UHFFFAOYSA-N |
Mol Weight | 260.29 g/mol |
Molecular Formula | C18H12O2 |
Exact Mass | 260.08373 g/mol |
SpectraBase Spectrum ID | CWot4PPjL2b |
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Name | 1-Pyreneacetic acid |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 392189 |
CAS Registry Number | 64709-55-3 |
Copyright | Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H12O2 |
InChI | 1S/C18H12O2/c19-16(20)10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)18(13)17(11)12/h1-9H,10H2,(H,19,20) |
InChIKey | SDJCLYBBPUHKCD-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 97% |
Solvent | DMSO-d6 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_008609 |