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Phenanthrene
SpectraBase Compound ID 48NXQMl7lPT
InChI InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H
InChIKey YNPNZTXNASCQKK-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C14H10
Exact Mass 178.07825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElynunSiUNF
Name Phenanthrene
CAS Registry Number 85-01-8
Classification Chemical Ingredient of tar
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Exact Mass 178.078250322 u
Formula C14H10
InChI InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H
InChIKey YNPNZTXNASCQKK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 178.234 g/mol
SMILES c1cccc2c1c1c(cc2)cccc1
SPLASH splash10-004i-1900000000-1b5b7cfff2f231b4ff12
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_2563