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(2(1)E)-2(3)-methoxy-2(2)H,4(1)H-2(5,2),4(2,5)-dipyrrola-1(1,3)-benzenacyclotridecaphan-9-ene
SpectraBase Compound ID Hs9SK6N2CXy
InChI InChI=1S/C25H28N2O/c1-28-25-18-23-20-12-9-11-19(16-20)10-7-5-3-2-4-6-8-13-21-14-15-22(26-21)17-24(25)27-23/h2-3,9,11-12,14-18,26H,4-8,10,13H2,1H3
InChIKey GTTQOLVPKWSQNQ-UHFFFAOYSA-N
Mol Weight 372.51 g/mol
Molecular Formula C25H28N2O
Exact Mass 372.220164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzoPBBCUAvl
Name (2(1)E)-2(3)-methoxy-2(2)H,4(1)H-2(5,2),4(2,5)-dipyrrola-1(1,3)-benzenacyclotridecaphan-9-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O
InChI InChI=1S/C25H28N2O/c1-28-25-18-23-20-12-9-11-19(16-20)10-7-5-3-2-4-6-8-13-21-14-15-22(26-21)17-24(25)27-23/h2-3,9,11-12,14-18,26H,4-8,10,13H2,1H3
InChIKey GTTQOLVPKWSQNQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1439-7633(20010105)2_1_60
Molecular Weight 372.512 g/mol
SMILES [nH]1c2CCCCC=CCCCc3cccc(C4=NC(=Cc1cc2)C(=C4)OC)c3
SPLASH splash10-00di-0019000000-a6ec5150960d86be3e4d
Source of Spectrum CBC-2-66-25
Wiley ID 1786501