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17-Methylidenepentacyclo[8.1.0.(1,9).0(3,8).0(11,16)]heptadeca-3,5,11,13,15-hexaene
SpectraBase Compound ID GKjhIhRg42h
InChI InChI=1S/C18H14/c1-10-15-11-6-2-3-7-12(11)16(10)18-14-9-5-4-8-13(14)17(15)18/h2-9,15-18H,1H2/t15-,16+,17-,18+
InChIKey WRFRHRRECCWAGP-USTZCAOPSA-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 32O3lTiQKUn
Name 17-Methylidenepentacyclo[8.1.0.(1,9).0(3,8).0(11,16)]heptadeca-3,5,11,13,15-hexaene
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/c1-10-15-11-6-2-3-7-12(11)16(10)18-14-9-5-4-8-13(14)17(15)18/h2-9,15-18H,1H2/t15-,16+,17-,18+
InChIKey WRFRHRRECCWAGP-USTZCAOPSA-N
Molecular Weight 230.310 g/mol
SMILES C1([C@@]2([C@@]3(C=4C=CC=CC4[C@@]3([C@]1(C=1C=CC=CC21)[H])[H])[H])[H])=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929177