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4-[4-(4"-Ethoxycarbonylphenylazo)phenyl]-2,6-(cyclopent-2'-en-1',4'-diyl)-4-aza-10-oxa-tricyclo[5.2.1.0(2,6)decane
SpectraBase Compound ID CVDdSxtCb7X
InChI InChI=1S/C28H29N3O3/c1-2-33-26(32)18-3-7-21(8-4-18)29-30-22-9-11-23(12-10-22)31-16-27-19-5-6-20(15-19)28(27,17-31)25-14-13-24(27)34-25/h3-12,19-20,24-25H,2,13-17H2,1H3/b30-29+/t19-,20+,24+,25-,27+,28-
InChIKey BTLFQYYTPNRDRO-FOLGHEENSA-N
Mol Weight 455.56 g/mol
Molecular Formula C28H29N3O3
Exact Mass 455.220892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9h8fOe7mem
Name 4-[4-(4"-Ethoxycarbonylphenylazo)phenyl]-2,6-(cyclopent-2'-en-1',4'-diyl)-4-aza-10-oxa-tricyclo[5.2.1.0(2,6)decane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29N3O3
InChI InChI=1S/C28H29N3O3/c1-2-33-26(32)18-3-7-21(8-4-18)29-30-22-9-11-23(12-10-22)31-16-27-19-5-6-20(15-19)28(27,17-31)25-14-13-24(27)34-25/h3-12,19-20,24-25H,2,13-17H2,1H3/b30-29+/t19-,20+,24+,25-,27+,28-
InChIKey BTLFQYYTPNRDRO-FOLGHEENSA-N
Molecular Weight 455.558 g/mol
SMILES [C@]123[C@@]([C@@]4(O[C@]3(CC4)[H])[H])([C@@]3(C[C@]2(C=C3)[H])[H])CN(C1)c1ccc(\N=N\c2ccc(C(=O)OCC)cc2)cc1
SPLASH splash10-05fu-2590300000-8e0bbaac159b8e861015
Source of Spectrum QE-20-328-3
Wiley ID 1586630