For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(+/-)-3-Deutero-3-[2'-(beta-deutero-beta-N-ethoxycarbonyl-N-methylamino-ethyl)-4',5'-dimethoxyphenyl)]-6,7-dirnethoxyisochromane

View entire compound with spectra: 1 MS (GC)

(+/-)-3-Deutero-3-[2'-(beta-deutero-beta-N-ethoxycarbonyl-N-methylamino-ethyl)-4',5'-dimethoxyphenyl)]-6,7-dirnethoxyisochromane
SpectraBase Compound ID KF6SVacR5gb
InChI InChI=1S/C25H33NO7/c1-7-32-25(27)26(2)9-8-16-10-21(28-3)24(31-6)14-19(16)20-11-17-12-22(29-4)23(30-5)13-18(17)15-33-20/h10,12-14,20H,7-9,11,15H2,1-6H3/i9D,20D
InChIKey CQGHZJBHRLHMAP-UUXCAACHSA-N
Mol Weight 461.55 g/mol
Molecular Formula C25H312D2NO7
Exact Mass 461.238256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2X30LrPlRJl
Name (+/-)-3-Deutero-3-[2'-(beta-deutero-beta-N-ethoxycarbonyl-N-methylamino-ethyl)-4',5'-dimethoxyphenyl)]-6,7-dirnethoxyisochromane
Alternate Name(s) Ethyl (2-(2-(6,7-dimethoxyisochroman-3-yl-3-d)-4,5-dimethoxyphenyl)ethyl-1-d)(methyl)carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31D2NO7
InChI InChI=1S/C25H33NO7/c1-7-32-25(27)26(2)9-8-16-10-21(28-3)24(31-6)14-19(16)20-11-17-12-22(29-4)23(30-5)13-18(17)15-33-20/h10,12-14,20H,7-9,11,15H2,1-6H3/i9D,20D
InChIKey CQGHZJBHRLHMAP-UUXCAACHSA-N
Molecular Weight 461.551 g/mol
SMILES c1(c(cc(c(c1)CC([2D])N(C)C(=O)OCC)C1(OCc2cc(c(cc2C1)OC)OC)[2D])OC)OC
SPLASH splash10-03di-0900000000-11ab4427831ad4e9e0c0
Source of Spectrum APC-321-7-(+/_)_D2_2
Wiley ID 1788391