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9,11-bis(4-methylphenoxy)naphtho[2,1-b][1,4]benzoxazepine
SpectraBase Compound ID 1aC9lnpNHpu
InChI InChI=1S/C31H23NO3/c1-20-7-12-23(13-8-20)33-25-17-29(34-24-14-9-21(2)10-15-24)27-19-32-31-26-6-4-3-5-22(26)11-16-28(31)35-30(27)18-25/h3-19H,1-2H3
InChIKey CNJUXCIPIIPLRK-UHFFFAOYSA-N
Mol Weight 457.53 g/mol
Molecular Formula C31H23NO3
Exact Mass 457.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGSVMAUSUWE
Name 9,11-bis(4-methylphenoxy)naphtho[2,1-b][1,4]benzoxazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H23NO3
InChI InChI=1S/C31H23NO3/c1-20-7-12-23(13-8-20)33-25-17-29(34-24-14-9-21(2)10-15-24)27-19-32-31-26-6-4-3-5-22(26)11-16-28(31)35-30(27)18-25/h3-19H,1-2H3
InChIKey CNJUXCIPIIPLRK-UHFFFAOYSA-N
Molecular Weight 457.529 g/mol
SMILES c1ccc2c3N=Cc4c(cc(cc4Oc4ccc(cc4)C)Oc4ccc(cc4)C)Oc3ccc2c1
SPLASH splash10-0a4l-3664900000-4b8a70370991906ec6e8
Synonyms 9,11-bis-p-tolyloxy-7-oxa-13-aza-benzo[4,5]cyclohepta[1,2-a]naphthalene
Wiley ID 1460577