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Benzo[f]ninhydrin monohydrate

View entire compound with spectra: 2 NMR, and 1 FTIR

Benzo[f]ninhydrin monohydrate
SpectraBase Compound ID 5y71tivaNvs
InChI InChI=1S/C13H8O4.H2O/c14-11-9-5-7-3-1-2-4-8(7)6-10(9)12(15)13(11,16)17;/h1-6,16-17H;1H2
InChIKey LCNHACKNQUILCO-UHFFFAOYSA-N
Mol Weight 246.22 g/mol
Molecular Formula C13H10O5
Exact Mass 246.052823 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JnVFJJhb1iY
Name Benzo[f]ninhydrin monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 310786
CAS Registry Number 38627-57-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O5
InChI InChI=1S/C13H8O4.H2O/c14-11-9-5-7-3-1-2-4-8(7)6-10(9)12(15)13(11,16)17;/h1-6,16-17H;1H2
InChIKey LCNHACKNQUILCO-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2,2-Dihydroxy-(1H)-benz[f]indene-1,3(2H)-dione
Wiley ID SIAL_13CNMR_006252