[4,5-Dimethoxy-2-(6,7-dimethoxy-3-isochromanyl)phenethyl]methylcarbamic acid, benzyl ester

SpectraBase Compound ID	86v4SjWkJ0j
InChI	InChI=1S/C30H35NO7/c1-31(30(32)38-18-20-9-7-6-8-10-20)12-11-21-13-26(33-2)29(36-5)17-24(21)25-14-22-15-27(34-3)28(35-4)16-23(22)19-37-25/h6-10,13,15-17,25H,11-12,14,18-19H2,1-5H3
InChIKey	DTHLOKSTGPBMNF-UHFFFAOYSA-N Google Search
Mol Weight	521.6 g/mol
Molecular Formula	C30H35NO7
Exact Mass	521.241352 g/mol

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SpectraBase Spectrum ID	5aOyTwlPf8h
Name	[4,5-Dimethoxy-2-(6,7-dimethoxy-3-isochromanyl)phenethyl]methylcarbamic acid, benzyl ester
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	521.241352464 u
Formula	C30H35NO7
InChI	InChI=1S/C30H35NO7/c1-31(30(32)38-18-20-9-7-6-8-10-20)12-11-21-13-26(33-2)29(36-5)17-24(21)25-14-22-15-27(34-3)28(35-4)16-23(22)19-37-25/h6-10,13,15-17,25H,11-12,14,18-19H2,1-5H3
InChIKey	DTHLOKSTGPBMNF-UHFFFAOYSA-N
Molecular Weight	521.610 g/mol
SMILES	COC=1C(=CC2=C(CC(C3=CC(OC)=C(C=C3CCN(C)C(=O)OCC=3C=CC=CC3)OC)OC2)C1)OC