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Benzene, 1-methyl-2-(1-propynyl)-
SpectraBase Compound ID HtL5gXm2x8u
InChI InChI=1S/C10H10/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7-8H,1-2H3
InChIKey VXKBMXXRLARKSD-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C10H10
Exact Mass 130.07825 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G684saGk7pK
Name Benzene, 1-methyl-2-(1-propynyl)-
CAS Registry Number 57497-13-9
Comments Less than 3 mono-isotopic peaks
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Formula C10H10
InChI InChI=1S/C10H10/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7-8H,1-2H3
InChIKey VXKBMXXRLARKSD-UHFFFAOYSA-N
Molecular Weight 130.190 g/mol
SMILES C(#CC)c1c(C)cccc1
SPLASH splash10-0059-0900000000-373446ee4ed0f52c18a2
Source of Spectrum J-41-750-0
Synonyms 1-methyl-2-prop-1-ynyl-benzene
Wiley ID 1133185