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

*Links on SpectraBase are not permalinks.

(3aR,4R,7S,7aS)-2-((E)-(5-bromo-2-hydroxy-3-nitrobenzylidene)amino)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione

View entire compound with spectra: 1 NMR

(3aR,4R,7S,7aS)-2-((E)-(5-bromo-2-hydroxy-3-nitrobenzylidene)amino)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
SpectraBase Compound ID C7jM4YHILmu
InChI InChI=1S/C18H14BrN3O5/c19-9-5-8(15(23)12(6-9)22(26)27)7-20-21-16(24)13-10-1-2-11(14(13)17(21)25)18(10)3-4-18/h1-2,5-7,10-11,13-14,23H,3-4H2/b20-7+/t10-,11+,13-,14?/m0/s1
InChIKey NTXWQPVPXPLLPV-KKTRHGBFSA-N
Mol Weight 432.23 g/mol
Molecular Formula C18H14BrN3O5
Exact Mass 431.011684 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID CwCg1fSw7nn
Name (3aR,4R,7S,7aS)-2-((E)-(5-bromo-2-hydroxy-3-nitrobenzylidene)amino)-3a,4,7,7a-tetrahydro-1H-spiro[4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H14BrN3O5/c19-9-5-8(15(23)12(6-9)22(26)27)7-20-21-16(24)13-10-1-2-11(14(13)17(21)25)18(10)3-4-18/h1-2,5-7,10-11,13-14,23H,3-4H2/b20-7+/t10-,11+,13-,14?/m0/s1
InChIKey NTXWQPVPXPLLPV-KKTRHGBFSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_59
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: /VSVE061423; UBI_ID: UBI-000060
Temperature 308 °C