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trans-2-[(E)-Oct-1'-enyl]-3-nitrotetrahydropyran
SpectraBase Compound ID F4zYYhXpHkk
InChI InChI=1S/C13H23NO3/c1-2-3-4-5-6-7-10-13-12(14(15)16)9-8-11-17-13/h7,10,12-13H,2-6,8-9,11H2,1H3/b10-7+/t12-,13+/m1/s1
InChIKey KOXGCHRBSWKDER-HKCLJGFPSA-N
Mol Weight 241.33 g/mol
Molecular Formula C13H23NO3
Exact Mass 241.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zQWKMJTDU
Name trans-2-[(E)-Oct-1'-enyl]-3-nitrotetrahydropyran
Alternate Name(s) (2S,3R)-3-nitro-2-[(1E)-1-octenyl]tetrahydro-2H-pyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23NO3
InChI InChI=1S/C13H23NO3/c1-2-3-4-5-6-7-10-13-12(14(15)16)9-8-11-17-13/h7,10,12-13H,2-6,8-9,11H2,1H3/b10-7+/t12-,13+/m1/s1
InChIKey KOXGCHRBSWKDER-HKCLJGFPSA-N
Molecular Weight 241.331 g/mol
SMILES [C@@]1(N(=O)=O)([C@@](OCCC1)(\C=C\CCCCCC)[H])[H]
SPLASH splash10-052f-9400000000-319dc191285265ffb084
Source of Spectrum F-50-1875-4
Wiley ID 1244099