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2-Cyclohexylamino-5-(4-nitro-phenyl)-furan-3,4-dicarboxylic Acid Di-tert-butyl Ester
SpectraBase Compound ID 3pSTvIWp905
InChI InChI=1S/C26H34N2O7/c1-25(2,3)34-23(29)19-20(24(30)35-26(4,5)6)22(27-17-10-8-7-9-11-17)33-21(19)16-12-14-18(15-13-16)28(31)32/h12-15,17,27H,7-11H2,1-6H3
InChIKey MQIDCTVEKIHMSM-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C26H34N2O7
Exact Mass 486.236601 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgudHXRnpMn
Name 2-Cyclohexylamino-5-(4-nitro-phenyl)-furan-3,4-dicarboxylic Acid Di-tert-butyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34N2O7
InChI InChI=1S/C26H34N2O7/c1-25(2,3)34-23(29)19-20(24(30)35-26(4,5)6)22(27-17-10-8-7-9-11-17)33-21(19)16-12-14-18(15-13-16)28(31)32/h12-15,17,27H,7-11H2,1-6H3
InChIKey MQIDCTVEKIHMSM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.20086
Molecular Weight 486.565 g/mol
SMILES N(c1oc(-c2ccc([N+](=O)[O-])cc2)c(C(=O)OC(C)(C)C)c1C(OC(C)(C)C)=O)C1CCCCC1
SPLASH splash10-05g0-5067900000-92ec1cef4b19c23b12a0
Source of Spectrum HAC-16-261-4c
Synonyms di-tert-butyl 2-(cyclohexylamino)-5-(4-nitrophenyl)furan-3,4-dicarboxylate
Wiley ID 1783539