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3-Benzoyl-2-hydroxy-1-isopropyl-1,3a-diazacylopent[a]azulenium hydroxide
SpectraBase Compound ID LmG08iYOj5z
InChI InChI=1S/C21H18N2O2/c1-14(2)22-18-13-16-11-7-4-8-12-17(16)23(18)19(21(22)25)20(24)15-9-5-3-6-10-15/h3-14H,1-2H3
InChIKey GQBMBZNTIOPVKR-UHFFFAOYSA-N
Mol Weight 330.39 g/mol
Molecular Formula C21H18N2O2
Exact Mass 330.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgHKRIrHk
Name 3-Benzoyl-2-hydroxy-1-isopropyl-1,3a-diazacylopent[a]azulenium hydroxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O2
InChI InChI=1S/C21H18N2O2/c1-14(2)22-18-13-16-11-7-4-8-12-17(16)23(18)19(21(22)25)20(24)15-9-5-3-6-10-15/h3-14H,1-2H3
InChIKey GQBMBZNTIOPVKR-UHFFFAOYSA-N
Molecular Weight 330.387 g/mol
SMILES c12[n+](c(c([n]2C2=CC=CC=CC2=C1)C(=O)c1ccccc1)[O-])C(C)C
SPLASH splash10-055r-3696000000-dace88dfbda9ab004ca6
Source of Spectrum O1-56-177-5
Wiley ID 1591639