9-oxofluorene-2,7-dicarboxylic acid, bis[3-(dibutylamino)propyl]ester, dihydrochloride, monohydrate

SpectraBase Compound ID	D9EWjmSlSku
InChI	InChI=1S/C37H54N2O5.2ClH.H2O/c1-5-9-19-38(20-10-6-2)23-13-25-43-36(41)29-15-17-31-32-18-16-30(28-34(32)35(40)33(31)27-29)37(42)44-26-14-24-39(21-11-7-3)22-12-8-4;;;/h15-18,27-28H,5-14,19-26H2,1-4H3;2*1H;1H2
InChIKey	QFFXNBYHVJDIMR-UHFFFAOYSA-N Google Search
Mol Weight	697.8 g/mol
Molecular Formula	C37H58Cl2N2O6
Exact Mass	696.367193 g/mol

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SpectraBase Spectrum ID	1vDR8xg5Sro
Name	9-OXOFLUORENE-2,7-DICARBOXYLIC ACID, BIS[3-(DIBUTYLAMINO)PROPYL] ESTER, DIHYDROCHLORIDE, MONOHYDRATE
Source of Sample	E. R. Andrews, Merrell-National Laboratories, Cincinnati, Ohio
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C37H58Cl2N2O6
InChI	InChI=1S/C37H54N2O5.2ClH.H2O/c1-5-9-19-38(20-10-6-2)23-13-25-43-36(41)29-15-17-31-32-18-16-30(28-34(32)35(40)33(31)27-29)37(42)44-26-14-24-39(21-11-7-3)22-12-8-4;;;/h15-18,27-28H,5-14,19-26H2,1-4H3;2*1H;1H2
InChIKey	QFFXNBYHVJDIMR-UHFFFAOYSA-N
Literature Reference	J. MED. CHEM. 16, 240(1973)
Melting Point	178-179C
Molecular Weight	697.778992
Synonyms	FLUORENE-2,7-DICARBOXYLIC ACID, 9-OXO-, BIS/3-/DIBUTYLAMINO/PROPYL/ ESTER, DIHYDROCHLORIDE, MONOHYDRATE
Technique	KBr WAFER