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(E)-2-Isopropyl-5-bromo-2-dicyanomethyladamantane
SpectraBase Compound ID 156wkhLPicA
InChI InChI=1S/C16H21BrN2/c1-10(2)16(14(8-18)9-19)12-3-11-4-13(16)7-15(17,5-11)6-12/h10-14H,3-7H2,1-2H3/t11-,12-,13+,15-,16-
InChIKey YJJZYXNCPNUTRC-VBKMGXBPSA-N
Mol Weight 321.26 g/mol
Molecular Formula C16H21BrN2
Exact Mass 320.088812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cw4Pfy5fzJ9
Name (E)-2-Isopropyl-5-bromo-2-dicyanomethyladamantane
Alternate Name(s) (E)-2-Isopropyl-5-bromo-2-dicyanomethyladamantane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21BrN2
InChI InChI=1S/C16H21BrN2/c1-10(2)16(14(8-18)9-19)12-3-11-4-13(16)7-15(17,5-11)6-12/h10-14H,3-7H2,1-2H3/t11-,12-,13+,15-,16-
InChIKey YJJZYXNCPNUTRC-VBKMGXBPSA-N
Molecular Weight 321.262 g/mol
SMILES [C@]1([C@]2(C[C@@]3(C[C@@]1(C[C@@](C3)(C2)[H])[H])Br)[H])(C(C#N)C#N)C(C)C
SPLASH splash10-006x-2397000000-da44de5113be028f4eb8
Source of Spectrum KC-0-2389-((E)-5-Br (i-Pr)
Wiley ID 828854