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(E) 4,5,5-Trimethyl-1-nitrohex-2-ene
SpectraBase Compound ID 4xs240FoVTF
InChI InChI=1S/C9H17NO2/c1-8(9(2,3)4)6-5-7-10(11)12/h5-6,8H,7H2,1-4H3/b6-5+
InChIKey YYBBWDWHAWXZRV-AATRIKPKSA-N
Mol Weight 171.24 g/mol
Molecular Formula C9H17NO2
Exact Mass 171.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXWgW5iJfFT
Name (E) 4,5,5-Trimethyl-1-nitrohex-2-ene
Alternate Name(s) (E)-4,5,5-trimethyl-1-nitrohex-2-ene
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Formula C9H17NO2
InChI InChI=1S/C9H17NO2/c1-8(9(2,3)4)6-5-7-10(11)12/h5-6,8H,7H2,1-4H3/b6-5+
InChIKey YYBBWDWHAWXZRV-AATRIKPKSA-N
Literature Reference DOI 10.1021/ol500114m
Molecular Weight 171.240 g/mol
SMILES CC(C(C)(C)C)\C=C\C[N+](=O)[O-]
SPLASH splash10-0a4i-9000000000-1bdbeea0b8ba1f668854
Source of Spectrum A1-16-1362/SMS9-3d
Wiley ID 1749202