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1-(2-Nitrocyclohexyl)butan-2,3-dione
SpectraBase Compound ID 4lGFfnjKkLE
InChI InChI=1S/C10H15NO4/c1-7(12)10(13)6-8-4-2-3-5-9(8)11(14)15/h8-9H,2-6H2,1H3
InChIKey QWHQDPKAFPIGNO-UHFFFAOYSA-N
Mol Weight 213.23 g/mol
Molecular Formula C10H15NO4
Exact Mass 213.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXYRARVGven
Name 1-(2-Nitrocyclohexyl)butan-2,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO4
InChI InChI=1S/C10H15NO4/c1-7(12)10(13)6-8-4-2-3-5-9(8)11(14)15/h8-9H,2-6H2,1H3
InChIKey QWHQDPKAFPIGNO-UHFFFAOYSA-N
Molecular Weight 213.233 g/mol
SMILES C1(N(=O)=O)C(CC(C(=O)C)=O)CCCC1
SPLASH splash10-000x-9100000000-7441b59354a36ddd32e9
Source of Spectrum SO-0-248-6
Synonyms 1-(2-nitrocyclohexyl)-2,3-butanedione trans-1-(2-Nitrocyclohexyl)butan-2,3-dione
Wiley ID 873384