2-.beta.-Benzyloxy-3-(N-ethylamino)-4-methoxy-6-phenyl-1,5,7-trioxabicyclo[4.4.0]decane

SpectraBase Compound ID	8WwqHOlhFs1
InChI	InChI=1S/C23H29NO5/c1-3-24-19-21(25-2)20-18(15-27-22(29-20)17-12-8-5-9-13-17)28-23(19)26-14-16-10-6-4-7-11-16/h4-13,18-24H,3,14-15H2,1-2H3/t18-,19-,20-,21+,22?,23?/m1/s1
InChIKey	QQOIPEBDUDNLLE-GCHWYBGCSA-N Google Search
Mol Weight	399.49 g/mol
Molecular Formula	C23H29NO5
Exact Mass	399.204573 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	JtTRmgDcDMl
Name	2-.beta.-Benzyloxy-3-(N-ethylamino)-4-methoxy-6-phenyl-1,5,7-trioxabicyclo[4.4.0]decane
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	399.204573033 u
Formula	C23H29NO5
InChI	InChI=1S/C23H29NO5/c1-3-24-19-21(25-2)20-18(15-27-22(29-20)17-12-8-5-9-13-17)28-23(19)26-14-16-10-6-4-7-11-16/h4-13,18-24H,3,14-15H2,1-2H3/t18-,19-,20-,21+,22?,23?/m1/s1
InChIKey	QQOIPEBDUDNLLE-GCHWYBGCSA-N
Molecular Weight	399.487 g/mol
SMILES	[C@]12(OC(C3=CC=CC=C3)OC[C@]1(OC(OCC1=CC=CC=C1)[C@@]([C@@]2(OC)[H])(NCC)[H])[H])[H]