Whisky - Congeners
Documentation
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Product Information
Analyte Data
Analyte Name
Concentration
CAS Number
Molecular Structure
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Isoamyl Alcohol (3-Methyl-1-Butanol)
58.2 g/100L
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CAS Number
Alternate CAS Number
Unlabelled CAS Number
Molecular Formula
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Molecular Weight
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Accurate Mass
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Melting Point
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Appearance/Form
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SMILES
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InChI
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IUPAC
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1-Propanol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C3 H8 O
Molecular Weight
60.10
Accurate Mass
60.0575
SMILES
CCCO
InChI
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
IUPAC
propan-1-ol
2-Methyl-1-Butanol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H12 O
Molecular Weight
88.15
Accurate Mass
88.0888
SMILES
CCC(C)CO
InChI
InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3
IUPAC
2-methylbutan-1-ol
Butyl Alcohol, n-butanol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H10 O
Molecular Weight
74.12
Accurate Mass
74.0732
SMILES
CCCCO
InChI
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
IUPAC
butan-1-ol
Isoamyl Alcohol (3-Methyl-1-Butanol)
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C5 H12 O
Molecular Weight
88.15
Accurate Mass
88.0888
SMILES
CC(C)CCO
InChI
InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
IUPAC
3-methylbutan-1-ol
Isobutanol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C4 H10 O
Molecular Weight
74.12
Accurate Mass
74.0732
SMILES
CC(C)CO
InChI
InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
IUPAC
2-methylpropan-1-ol
Methanol
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C H4 O
Molecular Weight
32.04
Accurate Mass
32.0262
SMILES
CO
InChI
InChI=1S/CH4O/c1-2/h2H,1H3
IUPAC
methanol
Product Data
Storage Temperature
+18°C
Shipping Temperature
Room Temperature
Country of Origin
UNITED KINGDOM
Transport Restrictions
Air Excepted
Tariff Code
38220000
Product Format
Matrix Material
Matrix
Whisky
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