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4,5-Methanochrysene
SpectraBase Compound ID 6GCCC7FKCP2
InChI InChI=1S/C19H12/c1-2-7-16-13(4-1)10-15-11-14-6-3-5-12-8-9-17(16)19(15)18(12)14/h1-10H,11H2
InChIKey GTDQLJVKXFXBMM-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C19H12
Exact Mass 240.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Be2iPQUIG1q
Name 4,5-Methanochrysene
CAS Registry Number 202-98-2
Comments Less than 3 mono-isotopic peaks
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Formula C19H12
InChI InChI=1S/C19H12/c1-2-7-16-13(4-1)10-15-11-14-6-3-5-12-8-9-17(16)19(15)18(12)14/h1-10H,11H2
InChIKey GTDQLJVKXFXBMM-UHFFFAOYSA-N
Molecular Weight 240.305 g/mol
SMILES c12c3c4ccccc4cc2Cc2c1c(cc3)ccc2
SPLASH splash10-000f-0090000000-e5dbba5633aad68c813d
Source of Spectrum J-49-555-0
Synonyms 4,5-Methylenechrysene 4H-Cyclopenta[def]chrysene Chrysene, 4,5-methylene- BRN 2450512 CCRIS 2129
Wiley ID 1243729