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

*Links on SpectraBase are not permalinks.
Hemibastadin-2
SpectraBase Compound ID EUUq5C4Rte2
InChI InChI=1S/C20H21Br3N2O4/c1-27-18-5-4-12(8-14(18)21)6-7-24-20(26)17(25-29-3)11-13-9-15(22)19(28-2)16(23)10-13/h4-5,8-10H,6-7,11H2,1-3H3,(H,24,26)/b25-17-
InChIKey NBPPBDKXJSJVJD-UQQQWYQISA-N
Mol Weight 593.11 g/mol
Molecular Formula C20H21Br3N2O4
Exact Mass 589.905146 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 9A2x3ffIL2z
Name Hemibastadin-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21Br3N2O4
InChI InChI=1S/C20H21Br3N2O4/c1-27-18-5-4-12(8-14(18)21)6-7-24-20(26)17(25-29-3)11-13-9-15(22)19(28-2)16(23)10-13/h4-5,8-10H,6-7,11H2,1-3H3,(H,24,26)/b25-17-
InChIKey NBPPBDKXJSJVJD-UQQQWYQISA-N
Molecular Weight 593.110 g/mol
SMILES N(C(\C(Cc1cc(Br)c(c(c1)Br)OC)=N/OC)=O)CCc1cc(Br)c(cc1)OC
SPLASH splash10-03di-1291000000-01e8cc79ebfbeeb6ab47
Source of Spectrum B-44-287-0
Synonyms (2Z)-N-[2-(3-bromo-4-methoxyphenyl)ethyl]-3-(3,5-dibromo-4-methoxyphenyl)-2-(methoxyimino)propanamide
Wiley ID 1409280