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1H-Cyclopropa[b]naphthalene, 1-(7H-benzocyclohepten-7-ylidene)-

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

1H-Cyclopropa[b]naphthalene, 1-(7H-benzocyclohepten-7-ylidene)-
SpectraBase Compound ID HuJYNsjb7fp
InChI InChI=1S/C22H14/c1-2-6-16-10-12-17(11-9-15(16)5-1)22-20-13-18-7-3-4-8-19(18)14-21(20)22/h1-14H
InChIKey PKEQQBOHMKVUIY-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C22H14
Exact Mass 278.10955 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4bXLj9hGMdo
Name 1H-Cyclopropa[B]naphthalene, 1-(7H-benzocyclohepten-7-ylidene)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.109550451 u
Formula C22H14
InChI InChI=1S/C22H14/c1-2-6-16-10-12-17(11-9-15(16)5-1)22-20-13-18-7-3-4-8-19(18)14-21(20)22/h1-14H
InChIKey PKEQQBOHMKVUIY-UHFFFAOYSA-N
SMILES C1(C=2C=C3C=CC=CC3=CC12)=C1C=CC2=CC=CC=C2C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866473