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1,3-Dimethylcyclopentane
SpectraBase Compound ID HHGHKp1EIZM
InChI InChI=1S/C7H14/c1-6-3-4-7(2)5-6/h6-7H,3-5H2,1-2H3
InChIKey XAZKFISIRYLAEE-UHFFFAOYSA-N
Mol Weight 98.19 g/mol
Molecular Formula C7H14
Exact Mass 98.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkJ75jET1qF
Name 1,3-Dimethylcyclopentane
CAS Registry Number 1759-58-6
Classification Solvent
Comments Original RI info: <1000*
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Exact Mass 98.109550451 u
Formula C7H14
InChI InChI=1S/C7H14/c1-6-3-4-7(2)5-6/h6-7H,3-5H2,1-2H3
InChIKey XAZKFISIRYLAEE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 98.189 g/mol
SMILES C1C(CC(C1)C)C
SPLASH splash10-0a6u-9000000000-75c9789e8f868dda0cfb
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_3821