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Pentacyclo[7.5.0.0(2,7).0(3,5).0(4,8)]tetradeca-10,12-diene
SpectraBase Compound ID 9bNm3tih14z
InChI InChI=1S/C14H16/c1-2-4-7-8(5-3-1)12-9-6-10-13(11(7)9)14(10)12/h1-4,7-14H,5-6H2/t7?,8?,9-,10-,11-,12+,13-,14+/m0/s1
InChIKey NGWKSEZRNXUHFM-VJDSWIFISA-N
Mol Weight 184.28 g/mol
Molecular Formula C14H16
Exact Mass 184.125201 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K3MHvRUlplc
Name Pentacyclo[7.5.0.0(2,7).0(3,5).0(4,8)]tetradeca-10,12-diene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 184.125200515 u
Formula C14H16
InChI InChI=1S/C14H16/c1-2-4-7-8(5-3-1)12-9-6-10-13(11(7)9)14(10)12/h1-4,7-14H,5-6H2/t7?,8?,9-,10-,11-,12+,13-,14+/m0/s1
InChIKey NGWKSEZRNXUHFM-VJDSWIFISA-N
Molecular Weight 184.282 g/mol
SMILES [C@]12([C@]3([C@]4(C5C=CC=CCC5[C@@]([C@@]23[H])([C@]4(C1)[H])[H])[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873272