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N-DOCOSANE
SpectraBase Compound ID CgEYT0DqCg1
InChI InChI=1S/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey HOWGUJZVBDQJKV-UHFFFAOYSA-N
Mol Weight 310.6 g/mol
Molecular Formula C22H46
Exact Mass 310.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AafAPHcTvkZ
Name Docosane
CAS Registry Number 629-97-0
Classification Hydrocarbon
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Exact Mass 310.359951481 u
Formula C22H46
InChI InChI=1S/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey HOWGUJZVBDQJKV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 310.610 g/mol
SMILES C(CCCCCCCCCCCCCCCCCCCC)C
SPLASH splash10-0ab9-9000000000-644ea62f67d4ffadf3a7
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_4946