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(E)-1-iso-butyl-4-(prop-1-en-1-yl)benzene
SpectraBase Compound ID 6vPSRPTUT4f
InChI InChI=1S/C13H18/c1-4-5-12-6-8-13(9-7-12)10-11(2)3/h4-9,11H,10H2,1-3H3/b5-4+
InChIKey GJYSYQQXHBPJRD-SNAWJCMRSA-N
Mol Weight 174.29 g/mol
Molecular Formula C13H18
Exact Mass 174.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBuTvw6qbO
Name (E)-1-iso-butyl-4-(prop-1-en-1-yl)benzene
Carrier Gas Hydrogen (1.7 ml/min, 1.2 bar)
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Exact Mass 174.140850580 u
Formula C13H18
GC Column Macherey-Nagel Optima-1-MS (30 m x 0.25 mm)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C13H18/c1-4-5-12-6-8-13(9-7-12)10-11(2)3/h4-9,11H,10H2,1-3H3/b5-4+
InChIKey GJYSYQQXHBPJRD-SNAWJCMRSA-N
Instrument Name Agilent 5973 N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601283
Molecular Weight 174.287 g/mol
Quality 193
SMILES C1=C(C=CC(=C1)CC(C)C)\C=C\C
SPLASH splash10-008c-2900000000-85b99c67cf203f64daf9
Source of Spectrum QE-22-SM25-25-1 (DOI: 10.1002/chem.201601283)
Wiley ID 1903349