BENZO[E]PYRENE(192-97-2) MS
Product NameBENZO[E]PYRENE
CAS192-97-2
Molecular FormulaC20H12
Molecular Weight252.31
InChIInChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H
InChIKey TXVHTIQJNYSSKO-UHFFFAOYSA-N
SmilesC1=C2C3=C4C(C=C2)=CC=CC4=C2C=CC=CC2=C3C=C1
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MassMS-NW-7510 benzo(e)pyrene C20H12 (Mass of molecular ion: 252)
Source Temperature: 180 °C Sample Temperature: 130 °C Direct, 75 eV
99.0 1.3 111.0 1.5 111.5 1.4 112.0 4.3 112.5 1.6 113.0 6.2 113.5 1.1 123.5 1.0 124.0 4.8 124.5 3.2 125.0 11.3 125.5 3.7 126.0 11.1 126.5 2.4 223.0 1.0 224.0 2.5 225.0 1.5 226.0 2.0 248.0 4.6 249.0 3.2 250.0 21.8 251.0 7.8 252.0 100.0 253.0 21.7 254.0 2.1
in CDCl3
KBr disc
nujol mull
