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

*Links on SpectraBase are not permalinks.
.delta.3,.delta.5-2-Tryptophyl-4-carbo-tert-butoxy-5-carbomethoxy-7-[1,1-(ethylenedioxy)-ethyl]hexahydroisoquinoline
SpectraBase Compound ID ExQ9miwWAzx
InChI InChI=1S/C30H38N2O6/c1-29(2,3)38-28(34)24-18-32(11-10-19-16-31-25-9-7-6-8-22(19)25)17-20-14-21(30(4)36-12-13-37-30)15-23(26(20)24)27(33)35-5/h6-9,15-16,18,20-21,26,31H,10-14,17H2,1-5H3
InChIKey WMAVEXCWAYJELO-UHFFFAOYSA-N
Mol Weight 522.6 g/mol
Molecular Formula C30H38N2O6
Exact Mass 522.272987 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 CDSSCpJx8jp
Name .delta.3,.delta.5-2-Tryptophyl-4-carbo-tert-butoxy-5-carbomethoxy-7-[1,1-(ethylenedioxy)-ethyl]hexahydroisoquinoline
Alternate Name(s) 4-tert-Butyl 5-methyl 2-[2-(1H-indol-3-yl)ethyl]-7-(2-methyl-1,3-dioxolan-2-yl)-1,2,4a,7,8,8a-hexahydro-4,5-isoquinolinedicarboxylate
CAS Registry Number 87371-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H38N2O6
InChI InChI=1S/C30H38N2O6/c1-29(2,3)38-28(34)24-18-32(11-10-19-16-31-25-9-7-6-8-22(19)25)17-20-14-21(30(4)36-12-13-37-30)15-23(26(20)24)27(33)35-5/h6-9,15-16,18,20-21,26,31H,10-14,17H2,1-5H3
InChIKey WMAVEXCWAYJELO-UHFFFAOYSA-N
Molecular Weight 522.642 g/mol
SMILES [nH]1c2c(c(c1)CCN1C=C(C3C(=CC(C4(OCCO4)C)CC3C1)C(=O)OC)C(OC(C)(C)C)=O)cccc2
SPLASH splash10-000i-9100100000-8546c2d55a8c402c1552
Source of Spectrum J-48-4265-0
Wiley ID 1402288