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10,15-Dibenzyl-5,6,10,15,21-pentaaza-tricyclo[15.3.1.1(3,7)]docosa-1(21),6,12,17,19-pentaen-4-one
SpectraBase Compound ID JUH82sfhlYO
InChI InChI=1S/C31H35N5O/c37-31-27-20-28-14-9-15-30(32-28)24-36(23-26-12-5-2-6-13-26)18-8-7-17-35(19-16-29(21-27)33-34-31)22-25-10-3-1-4-11-25/h1-15,27H,16-24H2,(H,34,37)/b8-7-
InChIKey FXNWDDDNQCJZGW-FPLPWBNLSA-N
Mol Weight 493.7 g/mol
Molecular Formula C31H35N5O
Exact Mass 493.284161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55UBlmLJnCQ
Name 10,15-Dibenzyl-5,6,10,15,21-pentaaza-tricyclo[15.3.1.1(3,7)]docosa-1(21),6,12,17,19-pentaen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H35N5O
InChI InChI=1S/C31H35N5O/c37-31-27-20-28-14-9-15-30(32-28)24-36(23-26-12-5-2-6-13-26)18-8-7-17-35(19-16-29(21-27)33-34-31)22-25-10-3-1-4-11-25/h1-15,27H,16-24H2,(H,34,37)/b8-7-
InChIKey FXNWDDDNQCJZGW-FPLPWBNLSA-N
Molecular Weight 493.655 g/mol
SMILES N1C(C2Cc3nc(CN(C\C=C/CN(CCC(=N1)C2)Cc1ccccc1)Cc1ccccc1)ccc3)=O
SPLASH splash10-0006-9000000000-8a61970d0f40ce6857d0
Source of Spectrum K1-2001-4205-38
Wiley ID 813561