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3-Amino-4-(3-bromophenyl)-1-dicyanomethylidene-1,3a,4,4a-tetrahydrocyclopropa[c]pyrrole-3a,4a-dicarbonitrile
SpectraBase Compound ID DfOKatgTaiQ
InChI InChI=1S/C16H7BrN6/c17-11-3-1-2-9(4-11)12-15(7-20)13(10(5-18)6-19)23-14(22)16(12,15)8-21/h1-4,12H,(H2,22,23)
InChIKey YNSUUEGLKCBEEJ-UHFFFAOYSA-N
Mol Weight 363.18 g/mol
Molecular Formula C16H7BrN6
Exact Mass 361.991557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQeNw0SpYu3
Name 3-Amino-4-(3-bromophenyl)-1-dicyanomethylidene-1,3a,4,4a-tetrahydrocyclopropa[c]pyrrole-3a,4a-dicarbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H7BrN6
InChI InChI=1S/C16H7BrN6/c17-11-3-1-2-9(4-11)12-15(7-20)13(10(5-18)6-19)23-14(22)16(12,15)8-21/h1-4,12H,(H2,22,23)
InChIKey YNSUUEGLKCBEEJ-UHFFFAOYSA-N
Molecular Weight 363.178 g/mol
SMILES NC=1C2(C(C(=C(C#N)C#N)N1)(C#N)C2c1cc(Br)ccc1)C#N
SPLASH splash10-03di-0009000000-66a8e9c20cd01558b124
Source of Spectrum O1-47-364-3b
Wiley ID 1669668