John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5pYIUxdFjC9 SpectraBase Spectrum ID=2BrnH9m91tc

(accessed ).
DBDVYNPELMKVDM-KAYWLYCHSA-N
SpectraBase Compound ID 5pYIUxdFjC9
InChI InChI=1S/C27H23Br2NO5/c1-4-11-30-14-17-12-15-13-19(29)9-10-20(15)22-21(24(32)34-2)23(31)27(30,25(33)35-3)26(17,22)16-5-7-18(28)8-6-16/h5-10,12-13H,4,11,14H2,1-3H3/t26-,27-/m1/s1
InChIKey DBDVYNPELMKVDM-KAYWLYCHSA-N
Mol Weight 601.29 g/mol
Molecular Formula C27H23Br2NO5
Exact Mass 598.994295 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2BrnH9m91tc
Name DBDVYNPELMKVDM-KAYWLYCHSA-N
Compound Number 3DC
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H23Br2NO5
InChI InChI=1S/C27H23Br2NO5/c1-4-11-30-14-17-12-15-13-19(29)9-10-20(15)22-21(24(32)34-2)23(31)27(30,25(33)35-3)26(17,22)16-5-7-18(28)8-6-16/h5-10,12-13H,4,11,14H2,1-3H3/t26-,27-/m1/s1
InChIKey DBDVYNPELMKVDM-KAYWLYCHSA-N
Literature Reference Author Y.YOSHITAKE,K.YAMAGUCHI,C.KAI,T.AKIYAMA,C.HANDA,T.JIKYO,K.HA RANO
Literature Reference Citation J.ORG.CHEM.,66,8902(2001)
Literature Reference DOI 10.1021/jo015941o
Molecular Weight 601.291 g/mol
Solvent CDCl3
Source File Reference UWVN26584
SpectraBase Batch ID JieArSc3zIo