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Cyclooctanone, 2-(3-hydroxy-5-hexenyl)-2-nitro-, (R*,S*)-

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Cyclooctanone, 2-(3-hydroxy-5-hexenyl)-2-nitro-, (R*,S*)-
SpectraBase Compound ID 3efpIBV04jy
InChI InChI=1S/C14H23NO4/c1-2-7-12(16)9-11-14(15(18)19)10-6-4-3-5-8-13(14)17/h2,12,16H,1,3-11H2
InChIKey ZEXXFFSBCXSOQE-UHFFFAOYSA-N
Mol Weight 269.34 g/mol
Molecular Formula C14H23NO4
Exact Mass 269.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9a09LZY9Ah
Name Cyclooctanone, 2-(3-hydroxy-5-hexenyl)-2-nitro-, (R*,S*)-
Alternate Name(s) 2-(3-hydroxy-5-hexenyl)-2-nitrocyclooctanone
CAS Registry Number 94239-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO4
InChI InChI=1S/C14H23NO4/c1-2-7-12(16)9-11-14(15(18)19)10-6-4-3-5-8-13(14)17/h2,12,16H,1,3-11H2
InChIKey ZEXXFFSBCXSOQE-UHFFFAOYSA-N
Molecular Weight 269.341 g/mol
SMILES OC(CCC1(N(=O)=O)C(=O)CCCCCC1)CC=C
SPLASH splash10-05nf-9100000000-eb574a80cfe270ab952b
Source of Spectrum H-67-1450-0
Wiley ID 1273144