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2-Amino-4-[5-(4-bromophenyl)-2-furanyl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
SpectraBase Compound ID DEUJDDrBPA8
InChI InChI=1S/C23H17BrN4O/c24-15-7-5-14(6-8-15)19-9-10-20(29-19)21-17-4-2-1-3-16(17)18(11-25)22(28)23(21,12-26)13-27/h3,5-10,17,21H,1-2,4,28H2
InChIKey IFLRSSHWMOJWAA-UHFFFAOYSA-N
Mol Weight 445.32 g/mol
Molecular Formula C23H17BrN4O
Exact Mass 444.058574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uhDdNsuZ6
Name 2-Amino-4-[5-(4-bromophenyl)-2-furanyl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17BrN4O
InChI InChI=1S/C23H17BrN4O/c24-15-7-5-14(6-8-15)19-9-10-20(29-19)21-17-4-2-1-3-16(17)18(11-25)22(28)23(21,12-26)13-27/h3,5-10,17,21H,1-2,4,28H2
InChIKey IFLRSSHWMOJWAA-UHFFFAOYSA-N
Molecular Weight 445.320 g/mol
SMILES NC=1C(C(C2C(C1C#N)=CCCC2)c1ccc(o1)-c1ccc(cc1)Br)(C#N)C#N
SPLASH splash10-000i-4940100000-941597d2025f2b15c045
Synonyms 2-Amino-4-[5-(4-bromophenyl)-2-furyl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile 2-Azanyl-4-[5-(4-bromophenyl)furan-2-yl]-4a,5,6,7-tetrahydro-4H-naphthalene-1,3,3-tricarbonitrile
Wiley ID 1454532