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2-(Hexynyl)cyclohexyl 4-nitrobenzoate
SpectraBase Compound ID KEth8bsd2TK
InChI InChI=1S/C19H23NO4/c1-2-3-4-5-8-15-9-6-7-10-18(15)24-19(21)16-11-13-17(14-12-16)20(22)23/h11-15,18H,2-4,6-7,9-10H2,1H3/t15-,18+/m0/s1
InChIKey ICHGBUGJZYQHIZ-MAUKXSAKSA-N
Mol Weight 329.4 g/mol
Molecular Formula C19H23NO4
Exact Mass 329.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QB2YZ1IOLs
Name 2-(Hexynyl)cyclohexyl 4-nitrobenzoate
Alternate Name(s) (1R,2R)-2-(Hexynyl)cyclohexyl 4-nitrobenzoate 2-(1-hexynyl)cyclohexyl 4-nitrobenzoate [(1R,2R)-2-hex-1-ynylcyclohexyl] 4-nitrobenzoate
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Formula C19H23NO4
InChI InChI=1S/C19H23NO4/c1-2-3-4-5-8-15-9-6-7-10-18(15)24-19(21)16-11-13-17(14-12-16)20(22)23/h11-15,18H,2-4,6-7,9-10H2,1H3/t15-,18+/m0/s1
InChIKey ICHGBUGJZYQHIZ-MAUKXSAKSA-N
Molecular Weight 329.396 g/mol
SMILES c1(N(=O)=O)ccc(C(O[C@]2([C@@](C#CCCCC)(CCCC2)[H])[H])=O)cc1
SPLASH splash10-0udi-3900000000-cabe7d8c513a3490fb73
Source of Spectrum KC-0-3473-13
Wiley ID 831889