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1,3-Cyclohexadecanedione, 6-nitro-
SpectraBase Compound ID 3uN7n622NdW
InChI InChI=1S/C16H27NO4/c18-15-10-8-6-4-2-1-3-5-7-9-14(17(20)21)11-12-16(19)13-15/h14H,1-13H2
InChIKey XBIBOEZLGRUGLN-UHFFFAOYSA-N
Mol Weight 297.4 g/mol
Molecular Formula C16H27NO4
Exact Mass 297.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6JyOTOEuy5
Name 1,3-Cyclohexadecanedione, 6-nitro-
CAS Registry Number 86572-48-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO4
InChI InChI=1S/C16H27NO4/c18-15-10-8-6-4-2-1-3-5-7-9-14(17(20)21)11-12-16(19)13-15/h14H,1-13H2
InChIKey XBIBOEZLGRUGLN-UHFFFAOYSA-N
Molecular Weight 297.395 g/mol
SMILES C1(N(=O)=O)CCC(CC(=O)CCCCCCCCCC1)=O
SPLASH splash10-05nf-9100000000-d6ef7f9936cbad5f6965
Source of Spectrum H-66-859-0
Synonyms 6-Nitro-1,3-cyclohexadecanedione 6-Nitro-cylohexadecane-1,3-dione
Wiley ID 1300093