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PHENYLCYCLOOCTATETRAENE

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PHENYLCYCLOOCTATETRAENE
SpectraBase Compound ID Kwn8pb2vwpe
InChI InChI=1S/C14H12/c1-2-5-9-13(10-6-3-1)14-11-7-4-8-12-14/h1-12H/b2-1-,3-1-,5-2-,6-3-,9-5-,10-6-,13-9+,13-10+
InChIKey GONKWCNPVBWYRY-ZACRBJJOSA-N
Mol Weight 180.25 g/mol
Molecular Formula C14H12
Exact Mass 180.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ig29LtBOwJg
Name 1,3,5,7-Cyclooctatetraene, 1-phenyl-
CAS Registry Number 4603-00-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12
InChI InChI=1S/C14H12/c1-2-5-9-13(10-6-3-1)14-11-7-4-8-12-14/h1-12H/b2-1-,3-1-,5-2-,6-3-,9-5-,10-6-,13-9+,13-10+
InChIKey GONKWCNPVBWYRY-ZACRBJJOSA-N
Molecular Weight 180.250 g/mol
SMILES c1(\C2=C/C=C\C=C/C=C\2)ccccc1
SPLASH splash10-0059-1900000000-32b0a96e51326da23fc2
Source of Spectrum HE-1982-0-0
Wiley ID 1177117