For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Benzo[a]pyrene, 4,5-dihydro-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Benzo[a]pyrene, 4,5-dihydro-
SpectraBase Compound ID KeaDfnc9LPb
InChI InChI=1S/C20H14/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-7,10-12H,8-9H2
InChIKey WMXZGBBYGZWMCZ-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C20H14
Exact Mass 254.10955 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5FGrgAz6Npl
Name Benzo[A]pyrene, 4,5-dihydro-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.109550451 u
Formula C20H14
InChI InChI=1S/C20H14/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-7,10-12H,8-9H2
InChIKey WMXZGBBYGZWMCZ-UHFFFAOYSA-N
Molecular Weight 254.332 g/mol
SMILES C1=CC=C2C(=C1)C=C1C3=C2C=CC=2C3=C(C=CC2)CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.823089