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(Q82856268)
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English
BENZENE, (1-METHYLDECYL)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
232.219100896
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₈
0 references
canonical SMILES
C=1C=CC(=CC1)C(C)CCCCCCCCC
0 references
found in taxon
Acca sellowiana
1 reference
stated in
Compositional Analysis and Aroma Evaluation of Feijoa Essential Oils from New Zealand Grown Cultivars
Identifiers
InChI
InChI=1S/C17H28/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h9,11-12,14-16H,3-8,10,13H2,1-2H3
0 references
InChIKey
YHJBCRBYDBNEIK-UHFFFAOYSA-N
0 references
CAS Registry Number
4536-88-3
0 references
PubChem CID
20656
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
YHJBCRBYDBNEIK-UHFFFAOYSA-N
ChEBI ID
183285
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H28/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h9,11-12,14-16H,3-8,10,13H2,1-2H3
UniChem compound ID
43003830
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP012307
0 references
DSSTox substance ID
DTXSID60874981
1 reference
matched by identifier from
InChIKey
InChIKey
YHJBCRBYDBNEIK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID601013105
0 references
KNApSAcK ID
C00055571
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YHJBCRBYDBNEIK-UHFFFAOYSA-N
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