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Dicyano[2.3]-2-methyl-4-t-butylmetacyclophan-1-ene
SpectraBase Compound ID 6G3CiFMZmJj
InChI InChI=1S/C29H34N2/c1-19-12-13-21(28(2,3)4)15-24(19)26(17-30)27(18-31)25-16-22(29(5,6)7)14-20-10-8-9-11-23(20)25/h12-16H,8-11H2,1-7H3/b27-26-
InChIKey BWPOJIZXUDOLLR-RQZHXJHFSA-N
Mol Weight 410.6 g/mol
Molecular Formula C29H34N2
Exact Mass 410.272199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4o89lZbnK5B
Name Dicyano[2.3]-2-methyl-4-t-butylmetacyclophan-1-ene
Comments Less than 3 mono-isotopic peaks
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Formula C29H34N2
InChI InChI=1S/C29H34N2/c1-19-12-13-21(28(2,3)4)15-24(19)26(17-30)27(18-31)25-16-22(29(5,6)7)14-20-10-8-9-11-23(20)25/h12-16H,8-11H2,1-7H3/b27-26-
InChIKey BWPOJIZXUDOLLR-RQZHXJHFSA-N
Molecular Weight 410.605 g/mol
SMILES c1(\C(=C/(c2cc(C(C)(C)C)ccc2C)C#N)C#N)c2c(CCCC2)cc(c1)C(C)(C)C
SPLASH splash10-000i-0009200000-3e27d163c89d4876c202
Source of Spectrum AT-42-4347-3
Wiley ID 855093