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Valerylcymantrene
SpectraBase Compound ID HGDk5PN8aXZ
InChI InChI=1S/C10H13O.3CO.Mn/c1-2-3-8-10(11)9-6-4-5-7-9;3*1-2;/h4-7H,2-3,8H2,1H3;;;;
InChIKey KCXKWJSCDYCGGJ-UHFFFAOYSA-N
Mol Weight 284.15 g/mol
Molecular Formula C13H9MnO4
Exact Mass 283.988127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jSqj7mVveL
Name Valerylcymantrene
CAS Registry Number 67606-67-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13MnO4
InChI InChI=1S/C10H13O.3CO.Mn/c1-2-3-8-10(11)9-6-4-5-7-9;3*1-2;/h4-7H,2-3,8H2,1H3;;;;
InChIKey KCXKWJSCDYCGGJ-UHFFFAOYSA-N
Molecular Weight 284.149 g/mol
SMILES [Mn].[O+]#[C-].[O+]#[C-].[O+]#[C-].C(=O)([C]1[C][C][C][C]1)CCCC
SPLASH splash10-0zfr-9270000000-0020f0f24d32126d72df
Source of Spectrum W5-1989-36910-28626
Synonyms 1-Pentanoylcyclopentane-1,2,3,4,5-pentaide tris(methanidylidyneoxidanium) manganese
Wiley ID 1291387