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Benzene, 2-(1,3-butadienyl)-1,3,5-trimethyl-

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Benzene, 2-(1,3-butadienyl)-1,3,5-trimethyl-
SpectraBase Compound ID 7uAkjXce2IS
InChI InChI=1S/C13H16/c1-5-6-7-13-11(3)8-10(2)9-12(13)4/h5-9H,1H2,2-4H3/b7-6+
InChIKey YOPHSFAXJIMOIN-VOTSOKGWSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1EOJileBvM
Name 1,3-Butadiene, 1-mesityl-
CAS Registry Number 5732-00-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-5-6-7-13-11(3)8-10(2)9-12(13)4/h5-9H,1H2,2-4H3/b7-6+
InChIKey YOPHSFAXJIMOIN-VOTSOKGWSA-N
Molecular Weight 172.271 g/mol
SMILES Cc1cc(C)c(\C=C\C=C)c(C)c1
SPLASH splash10-0a4l-0900000000-45070c792b7cbdde1d70
Source of Spectrum H-56-2939-7
Synonyms Benzene, 2-(1,3-butadienyl)-1,3,5-trimethyl- 2-[(1E)-buta-1,3-dienyl]-1,3,5-trimethyl-benzene Mesitylene, 2-(1,3-butadienyl)-
Wiley ID 1169472