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(Z)-4-Bromo-N-(2-S-[2.2]paracyclophanyl-2,3-dihydroquinazolin-4(1H)-ylidne)aniline
SpectraBase Compound ID AOln6qzyWwW
InChI InChI=1S/C30H26BrN3/c31-24-14-16-25(17-15-24)32-29-26-6-1-2-7-28(26)33-30(34-29)27-19-22-9-8-20-4-3-5-21(18-20)10-12-23(27)13-11-22/h1-7,11,13-19,30,33H,8-10,12H2,(H,32,34)/t30-/m0/s1
InChIKey XFAASJXOVRLTEZ-PMERELPUSA-N
Mol Weight 508.46 g/mol
Molecular Formula C30H26BrN3
Exact Mass 507.131011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCTPjz77UYR
Name (Z)-4-Bromo-N-(2-S-[2.2]paracyclophanyl-2,3-dihydroquinazolin-4(1H)-ylidne)aniline
Appearance Yellowish white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H26BrN3
InChI InChI=1S/C30H26BrN3/c31-24-14-16-25(17-15-24)32-29-26-6-1-2-7-28(26)33-30(34-29)27-19-22-9-8-20-4-3-5-21(18-20)10-12-23(27)13-11-22/h1-7,11,13-19,30,33H,8-10,12H2,(H,32,34)/t30-/m0/s1
InChIKey XFAASJXOVRLTEZ-PMERELPUSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.a15
Molecular Weight 508.463 g/mol
SMILES N1[C@](c2c3CCc4cccc(CCc(cc3)c2)c4)(N\C(c2c1cccc2)=N/c1ccc(cc1)Br)[H]
SPLASH splash10-0pl0-1358970000-4101061fb600c7d72dcb
Source of Spectrum ARK-2009-154-3d
Wiley ID 1869596