Molecular species

SET-PT

IP

PDE

Gas

Water

Gas

Water

Phenol

825.8 (0.0)^b

521.0 (0.0)

857.5 (0.0)^c

18.7 (0.0)

PBT

759.5 (−66.3)

509.4 (−11.60)

949.6 (92.1)

30.5 (11.8)

PBT1

693.7 (−132.1)

443.3 (−77.5)

973.6 (116.1)

50.9 (32.2)

PBT2

805.0 (−20.8)

539.4 (18.35)

910.2 (52.7)

9.3 (−9.4)