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3-cyclohexyl-propyl-3,5-Dinitrobenzoate
SpectraBase Compound ID CYgpIQe9Mj8
InChI InChI=1S/C16H20N2O6/c19-16(24-8-4-7-12-5-2-1-3-6-12)13-9-14(17(20)21)11-15(10-13)18(22)23/h9-12H,1-8H2
InChIKey IPCFNHWOMQZEAX-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C16H20N2O6
Exact Mass 336.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3TSxi4W98mB
Name 3-cyclohexyl-propyl-3,5-Dinitrobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O6
InChI InChI=1S/C16H20N2O6/c19-16(24-8-4-7-12-5-2-1-3-6-12)13-9-14(17(20)21)11-15(10-13)18(22)23/h9-12H,1-8H2
InChIKey IPCFNHWOMQZEAX-UHFFFAOYSA-N
Molecular Weight 336.344 g/mol
SMILES c1([N+]([O-])=O)cc([N+]([O-])=O)cc(c1)C(=O)OCCCC1CCCCC1
SPLASH splash10-001j-9100000000-65699e6f9e898a6e80e7
Source of Spectrum H-59-324-6
Wiley ID 1332177