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2,6-Dimethyl-2-nitrohept-5-en-4-one
SpectraBase Compound ID 30TtlVjesWN
InChI InChI=1S/C9H15NO3/c1-7(2)5-8(11)6-9(3,4)10(12)13/h5H,6H2,1-4H3
InChIKey IUOGIKAEBUJVDN-UHFFFAOYSA-N
Mol Weight 185.22 g/mol
Molecular Formula C9H15NO3
Exact Mass 185.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRhkzCj7BM0
Name 2,6-Dimethyl-2-nitrohept-5-en-4-one
Alternate Name(s) 2,6-Dimethyl-6-nitro-2-hepten-4-one 2,6-Dimethyl-6-nitro-hept-2-en-4-one 2,6-Dimethyl-6-nitrohept-2-en-4-one
CAS Registry Number 73583-56-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15NO3
InChI InChI=1S/C9H15NO3/c1-7(2)5-8(11)6-9(3,4)10(12)13/h5H,6H2,1-4H3
InChIKey IUOGIKAEBUJVDN-UHFFFAOYSA-N
Molecular Weight 185.223 g/mol
SMILES C(N(=O)=O)(CC(C=C(C)C)=O)(C)C
SPLASH splash10-001i-9000000000-d53baf827260a543ae03
Source of Spectrum O1-47-874-5
Wiley ID 1669464