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(3S)-3-[2-(2H-Tetrahydropyran-2-yloxy)-1-nitroethyl]cycloheptanone
SpectraBase Compound ID B3C44HvLxK5
InChI InChI=1S/C14H23NO5/c16-12-6-2-1-5-11(9-12)13(15(17)18)10-20-14-7-3-4-8-19-14/h11,13-14H,1-10H2/t11-,13?,14?/m0/s1
InChIKey AVQKVLAYLXMUGJ-XGNXJENSSA-N
Mol Weight 285.34 g/mol
Molecular Formula C14H23NO5
Exact Mass 285.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1b01mrcseqQ
Name (3S)-3-[2-(2H-Tetrahydropyran-2-yloxy)-1-nitroethyl]cycloheptanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO5
InChI InChI=1S/C14H23NO5/c16-12-6-2-1-5-11(9-12)13(15(17)18)10-20-14-7-3-4-8-19-14/h11,13-14H,1-10H2/t11-,13?,14?/m0/s1
InChIKey AVQKVLAYLXMUGJ-XGNXJENSSA-N
Molecular Weight 285.340 g/mol
SMILES C(N(=O)=O)([C@@]1(CC(=O)CCCC1)[H])COC1OCCCC1
SPLASH splash10-0udi-0900000000-2941697b605187a5af41
Source of Spectrum F-53-11232-0
Synonyms (3S)-3-[1-nitro-2-(tetrahydro-2H-pyran-2-yloxy)ethyl]cycloheptanone
Wiley ID 803301