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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:188348 - 7-methyloctan-1-ol
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ChEBI Name
7-methyloctan-1-ol
ChEBI ID
CHEBI:188348
Definition
A primary alcohol that is octane which is substituted by a methyl group at position 7 and a hydroxy group at position 1. It is a fragrance ingredient.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Bruce May
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Formula
C9H20O
Net Charge
0
Average Mass
144.258
Monoisotopic Mass
144.15142
InChI
InChI=1S/C9H20O/c1-9(2)7-5-3-4-6-8-10/h9-10H,3-8H2,1-2H3
InChIKey
QDTDKYHPHANITQ-UHFFFAOYSA-N
SMILES
CC(C)CCCCCCO
Roles Classification
Application
(s):
fragrance
A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
7-methyloctan-1-ol (
CHEBI:188348
)
has role
fragrance (
CHEBI:48318
)
7-methyloctan-1-ol (
CHEBI:188348
)
is a
primary alcohol (
CHEBI:15734
)
IUPAC Name
7-methyloctan-1-ol
Synonyms
Sources
7-methyl-1-octanol
ChemIDplus
7-methyloctanol
ChEBI
Isononanol
SUBMITTER
isononyl alcohol
ChemIDplus
Manual Xref
Database
16158
ChemSpider
View more database links
Registry Numbers
Types
Sources
1733654
Reaxys Registry Number
Reaxys
2430-22-0
CAS Registry Number
ChemIDplus
2430-22-0
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
20659642
PubMed citation
Europe PMC
27315375
PubMed citation
Europe PMC
27551504
PubMed citation
Europe PMC
31615683
PubMed citation
Europe PMC
33797572
PubMed citation
Europe PMC
9216748
PubMed citation
Europe PMC
Last Modified
05 May 2022