Debug Info

object
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_id
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LArr8IqIs7s
spectrumID
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LArr8IqIs7s
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specType
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131072
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WMS3X:170608:1
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Mass Spectrum (GC)
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Bicyclo[8.2.2]tetradeca-5,10,12,13-tetraene, 5,6-dimethyl-, (Z)-
SpectraBase Compound ID 29FygLS59jg
InChI InChI=1S/C16H22/c1-13-5-3-7-15-9-11-16(12-10-15)8-4-6-14(13)2/h9-12H,3-8H2,1-2H3/b14-13-
InChIKey RYKBKMYPTKRGCH-YPKPFQOOSA-N
Mol Weight 214.35 g/mol
Molecular Formula C16H22
Exact Mass 214.172151 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LArr8IqIs7s
Name Bicyclo[8.2.2]tetradeca-5,10,12,13-tetraene, 5,6-dimethyl-, (Z)-
CAS Registry Number 66388-96-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22
InChI InChI=1S/C16H22/c1-13-5-3-7-15-9-11-16(12-10-15)8-4-6-14(13)2/h9-12H,3-8H2,1-2H3/b14-13-
InChIKey RYKBKMYPTKRGCH-YPKPFQOOSA-N
Molecular Weight 214.352 g/mol
SMILES C1\C(=C/(CCCc2ccc(CC1)cc2)C)C
SPLASH splash10-0uxr-1920000000-8dde443c562ea8a64def
Source of Spectrum C-100-1813-0
Synonyms Bicyclo[8.2.2]tetradeca-5,10,12,13-tetraene, 5,6-dimethyl-, (E)- 5,6-Dimethyl-bicyclo[8.2.2]tetradeca-5-cis,10,12,13-tetraene 5,6-Dimethyl-bicyclo[8.2.2]tetradeca-5-trans,10,12,13-tetraene 5,6-Dimethylbicyclo[8.2.2]tetradeca-1(12),5,10,13-tetraene
Wiley ID 1214237
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