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1-Bromo-6-n-pentylphenanthrene
SpectraBase Compound ID KYs8PPQjtjB
InChI InChI=1S/C19H19Br/c1-2-3-4-6-14-9-10-15-11-12-17-16(18(15)13-14)7-5-8-19(17)20/h5,7-13H,2-4,6H2,1H3
InChIKey OHXSJUUAGAPFIQ-UHFFFAOYSA-N
Mol Weight 327.27 g/mol
Molecular Formula C19H19Br
Exact Mass 326.067014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYVNotC1H0f
Name 1-Bromo-6-n-pentylphenanthrene
Comments Less than 3 mono-isotopic peaks
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Formula C19H19Br
InChI InChI=1S/C19H19Br/c1-2-3-4-6-14-9-10-15-11-12-17-16(18(15)13-14)7-5-8-19(17)20/h5,7-13H,2-4,6H2,1H3
InChIKey OHXSJUUAGAPFIQ-UHFFFAOYSA-N
Molecular Weight 327.265 g/mol
SMILES c1(cccc2c3cc(ccc3ccc12)CCCCC)Br
SPLASH splash10-00b9-0069000000-2a260b658b4b1f9b9623
Source of Spectrum C-119-2124-0
Synonyms 1-bromo-6-pentylphenanthrene
Wiley ID 760224