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2-cis-(3'-Methyl-buta-1',3'-dienyl)-toluene
SpectraBase Compound ID G2BTdNg1Xxe
InChI InChI=1S/C12H14/c1-10(2)8-9-12-7-5-4-6-11(12)3/h4-9H,1H2,2-3H3/b9-8-
InChIKey ZXYXTWJRZGFOED-HJWRWDBZSA-N
Mol Weight 158.24 g/mol
Molecular Formula C12H14
Exact Mass 158.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsF6WOqw0uQ
Name 2-cis-(3'-Methyl-buta-1',3'-dienyl)-toluene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14
InChI InChI=1S/C12H14/c1-10(2)8-9-12-7-5-4-6-11(12)3/h4-9H,1H2,2-3H3/b9-8-
InChIKey ZXYXTWJRZGFOED-HJWRWDBZSA-N
Literature Reference DOI 10.1002/hlca.19710540771
Molecular Weight 158.244 g/mol
SMILES Cc1ccccc1\C=C/C(=C)C
SPLASH splash10-002f-1900000000-2464c83e8f17a543e8ba
Source of Spectrum H-54-2346-cis_9
Synonyms (Z)-1-methyl-2-(3-methylbuta-1,3-dien-1-yl)benzene
Wiley ID 1799859