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9-benzylphenanthrene
SpectraBase Compound ID IxPA9YdMOY1
InChI InChI=1S/C21H16/c1-2-8-16(9-3-1)14-18-15-17-10-4-5-11-19(17)21-13-7-6-12-20(18)21/h1-13,15H,14H2
InChIKey UVJRAORIEHWRRK-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C21H16
Exact Mass 268.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFrtpQpllm4
Name 9-benzylphenanthrene
Carrier Gas (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.125200515 u
Formula C21H16
GC Column DB-5 (30 m x 250 micrometer, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C21H16/c1-2-8-16(9-3-1)14-18-15-17-10-4-5-11-19(17)21-13-7-6-12-20(18)21/h1-13,15H,14H2
InChIKey UVJRAORIEHWRRK-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202307042
SMILES C1=CC2=C(C=C1)C1=C(C(=C2)CC2=CC=CC=C2)C=CC=C1
SPLASH splash10-014i-0690000000-8ce86292e927d64363f3
Source of Spectrum ACI-62-SM11-Figure S4-11 (DOI: 10.1002/anie.202307042)
Wiley ID 1911915