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5,6-Dihydrobenzo[a]anthracene

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

5,6-Dihydrobenzo[a]anthracene
SpectraBase Compound ID CBXJ66GABJ8
InChI InChI=1S/C18H14/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-8,11-12H,9-10H2
InChIKey MKDSWPWRFOCIEX-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C18H14
Exact Mass 230.10955 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2l7xsSlUwse
Name 5,6-Dihydrobenz[A]anthracene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.109550451 u
Formula C18H14
InChI InChI=1S/C18H14/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-8,11-12H,9-10H2
InChIKey MKDSWPWRFOCIEX-UHFFFAOYSA-N
Molecular Weight 230.310 g/mol
SMILES C12=C(C=C3C(=C2)C=CC=C3)CCC=2C1=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.857772