2-[p-(dimethylamino)phenyl]-2-(2-hydroxypropyl)-4-pentenoic acid, gamma-lactone, diphosphate

SpectraBase Compound ID	I7TvOZttgZ0
InChI	InChI=1S/C16H21NO2.2H3O4P/c1-5-10-16(11-12(2)19-15(16)18)13-6-8-14(9-7-13)17(3)4;21-5(2,3)4/h5-9,12H,1,10-11H2,2-4H3;2(H3,1,2,3,4)
InChIKey	DPDAONSJAPAHEJ-UHFFFAOYSA-N Google Search
Mol Weight	455.34 g/mol
Molecular Formula	C16H27NO10P2
Exact Mass	455.11102 g/mol

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SpectraBase Spectrum ID	ARo7QBPfivY
Name	2-[p-(DIMETHYLAMINO)PHENYL]-2-(2-HYDROXYPROPYL)-4-PENTENOIC ACID, gamma-LACTONE, DIPHOSPHATE
Source of Sample	B. Bobranski, Academy of Pharmacy, Chemistry & Medicine, Wroclaw, Poland
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H27NO10P2
InChI	InChI=1S/C16H21NO2.2H3O4P/c1-5-10-16(11-12(2)19-15(16)18)13-6-8-14(9-7-13)17(3)4;21-5(2,3)4/h5-9,12H,1,10-11H2,2-4H3;2(H3,1,2,3,4)
InChIKey	DPDAONSJAPAHEJ-UHFFFAOYSA-N
Melting Point	139C
Molecular Weight	455.329010
Synonyms	VALERIC ACID, 2-ALLYL-2-/P-/DI- METHYLAMINO/PHENYL/-4-HYDROXY-, G- LACTONE, DIPHOSPHATE 4-PENTENOIC ACID, 2-/P-/DIMETHYL- AMINO/PHENYL/-2-/2-HYDROXYPROPYL/-, G- LACTONE, DIPHOSPHATE
Technique	KBr WAFER