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3-nitro-4H-cyclopenta[def]phenanthrene
SpectraBase Compound ID 6JtubmUHTjb
InChI InChI=1S/C15H9NO2/c17-16(18)13-7-6-10-5-4-9-2-1-3-11-8-12(13)15(10)14(9)11/h1-7H,8H2
InChIKey KJMTVKMFLVWQGG-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C15H9NO2
Exact Mass 235.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0Wu0BlUdW4
Name 3-nitro-4H-cyclopenta[def]phenanthrene
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.063328532 u
Formula C15H9NO2
GC Column DB-5 (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C15H9NO2/c17-16(18)13-7-6-10-5-4-9-2-1-3-11-8-12(13)15(10)14(9)11/h1-7H,8H2
InChIKey KJMTVKMFLVWQGG-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name Hewlett Packard 5970 B MSD
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240080208
Molecular Weight 235.242 g/mol
Quality 725
SMILES C=1([N+](=O)[O-])C=CC2=CC=C3C=CC=C4C3=C2C1C4
SPLASH splash10-000i-1950000000-7be6165f91d4f402c515
Source of Spectrum HRC-8-83-Figure 2-B (DOI: 10.1002/jhrc.1240080208)
Wiley ID 1912095