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1-(2',6'-Dimethylphenyl)-but-2-ene
SpectraBase Compound ID 4QxOziY5vHn
InChI InChI=1S/C12H16/c1-4-5-9-12-10(2)7-6-8-11(12)3/h4-8H,9H2,1-3H3/b5-4+
InChIKey VGZUNXFZNYZKRK-SNAWJCMRSA-N
Mol Weight 160.26 g/mol
Molecular Formula C12H16
Exact Mass 160.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34DmhxOchB8
Name 1-(2',6'-Dimethylphenyl)-but-2-ene
Alternate Name(s) (E)-2-(but-2-en-1-yl)-1,3-dimethylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16
InChI InChI=1S/C12H16/c1-4-5-9-12-10(2)7-6-8-11(12)3/h4-8H,9H2,1-3H3/b5-4+
InChIKey VGZUNXFZNYZKRK-SNAWJCMRSA-N
Literature Reference DOI 10.1002/hlca.19730560214
Molecular Weight 160.260 g/mol
SMILES c1(cccc(c1C\C=C\C)C)C
SPLASH splash10-01ot-1900000000-409faa25c171ad852640
Source of Spectrum H-56-703-13
Wiley ID 1801385