PIANO Aromatics Mixture 91
Product Code
DRE-GA0900091
CAS Number
24 AnalytesProduct Format
Mixture
Solvent
-
Product Categories
Product Information
Analyte Name
Concentration
CAS Number
Molecular Structure
1,2,4-Triethylbenzene
Accurate Mass
162.1409
Smiles
CCc1ccc(CC)c(CC)c1
InChI
InChI=1S/C12H18/c1-4-10-7-8-11(5-2)12(6-3)9-10/h7-9H,4-6H2,1-3H3
IUPAC
1,2,4-triethylbenzene
1,2-Diethylbenzene
Accurate Mass
134.1096
Smiles
CCc1ccccc1CC
InChI
InChI=1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3
IUPAC
1,2-diethylbenzene
1,2-Dimethyl-3-ethylbenzene
Accurate Mass
134.1096
Smiles
CCc1cccc(C)c1C
InChI
InChI=1S/C10H14/c1-4-10-7-5-6-8(2)9(10)3/h5-7H,4H2,1-3H3
IUPAC
1-ethyl-2,3-dimethylbenzene
1,2-Dimethyl-4-ethylbenzene
Accurate Mass
134.1096
Smiles
CCc1ccc(C)c(C)c1
InChI
InChI=1S/C10H14/c1-4-10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3
IUPAC
4-ethyl-1,2-dimethylbenzene
1,3,5-Triethylbenzene
Accurate Mass
162.1409
Smiles
CCc1cc(CC)cc(CC)c1
InChI
InChI=1S/C12H18/c1-4-10-7-11(5-2)9-12(6-3)8-10/h7-9H,4-6H2,1-3H3
IUPAC
1,3,5-triethylbenzene
1,3-Dimethyl-5-ethylbenzene
Accurate Mass
134.1096
Smiles
CCc1cc(C)cc(C)c1
InChI
InChI=1S/C10H14/c1-4-10-6-8(2)5-9(3)7-10/h5-7H,4H2,1-3H3
IUPAC
1-ethyl-3,5-dimethylbenzene
1,4-Dimethyl-2-ethylbenzene
Accurate Mass
134.1096
Smiles
CCc1cc(C)ccc1C
InChI
InChI=1S/C10H14/c1-4-10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3
IUPAC
2-ethyl-1,4-dimethylbenzene
1-Methyl-2-isopropylbenzene
Accurate Mass
134.1096
Smiles
CC(C)c1ccccc1C
InChI
InChI=1S/C10H14/c1-8(2)10-7-5-4-6-9(10)3/h4-8H,1-3H3
IUPAC
1-methyl-2-propan-2-ylbenzene
1-Methyl-2-n-propylbenzene
Accurate Mass
134.1096
Smiles
CCCc1ccccc1C
InChI
InChI=1S/C10H14/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7-8H,3,6H2,1-2H3
IUPAC
1-methyl-2-propylbenzene
1-Methyl-3-n-propylbenzene
Accurate Mass
134.1096
Smiles
CCCc1cccc(C)c1
InChI
InChI=1S/C10H14/c1-3-5-10-7-4-6-9(2)8-10/h4,6-8H,3,5H2,1-2H3
IUPAC
1-methyl-3-propylbenzene
1-Methyl-4-n-propylbenzene
Accurate Mass
134.1096
Smiles
CCCc1ccc(C)cc1
InChI
InChI=1S/C10H14/c1-3-4-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3
IUPAC
1-methyl-4-propylbenzene
2-Ethyl-m-xylene
Accurate Mass
134.1096
Smiles
CCc1c(C)cccc1C
InChI
InChI=1S/C10H14/c1-4-10-8(2)6-5-7-9(10)3/h5-7H,4H2,1-3H3
IUPAC
2-ethyl-1,3-dimethylbenzene
2-Ethyltoluene
Accurate Mass
120.0939
Smiles
CCc1ccccc1C
InChI
InChI=1S/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3
IUPAC
1-ethyl-2-methylbenzene
2-Methylbutylbenzene
Accurate Mass
148.1252
Smiles
CCC(C)Cc1ccccc1
InChI
InChI=1S/C11H16/c1-3-10(2)9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
IUPAC
2-methylbutylbenzene
2-tert-Butyltoluene
Accurate Mass
148.1252
Smiles
Cc1ccccc1C(C)(C)C
InChI
InChI=1S/C11H16/c1-9-7-5-6-8-10(9)11(2,3)4/h5-8H,1-4H3
IUPAC
1-tert-butyl-2-methylbenzene
3-Ethyltoluene
Accurate Mass
120.0939
Smiles
CCc1cccc(C)c1
InChI
InChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3
IUPAC
1-ethyl-3-methylbenzene
5-tert-Butyl-m-Xylene
Accurate Mass
162.1409
Smiles
Cc1cc(C)cc(c1)C(C)(C)C
InChI
InChI=1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3
IUPAC
1-tert-butyl-3,5-dimethylbenzene
Benzene
Accurate Mass
78.047
Smiles
c1ccccc1
InChI
InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
IUPAC
benzene
Ethylbenzene
Accurate Mass
106.0783
Smiles
CCc1ccccc1
InChI
InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3
IUPAC
ethylbenzene
Isopropylbenzene
Accurate Mass
120.0939
Smiles
CC(C)c1ccccc1
InChI
InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3
IUPAC
cumene
n-Butylbenzene
Accurate Mass
134.1096
Smiles
CCCCc1ccccc1
InChI
InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3
IUPAC
butylbenzene
p-(tert-Butyl)ethylbenzene
Accurate Mass
162.1409
Smiles
CCc1ccc(cc1)C(C)(C)C
InChI
InChI=1S/C12H18/c1-5-10-6-8-11(9-7-10)12(2,3)4/h6-9H,5H2,1-4H3
IUPAC
1-tert-butyl-4-ethylbenzene
sec-Butylbenzene
Accurate Mass
134.1096
Smiles
CCC(C)c1ccccc1
InChI
InChI=1S/C10H14/c1-3-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
IUPAC
butan-2-ylbenzene
tert-Butylbenzene
Accurate Mass
134.1096
Smiles
CC(C)(C)c1ccccc1
InChI
InChI=1S/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3
IUPAC
tert-butylbenzene
Storage Temperature
≤ Ambient
Shipping Temperature
Room Temperature
Product Format
Mixture
Solvent
-
