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(Q104254237)
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English
propyl 2-methylbutanoate
group of stereoisomers with the chemical formula C₈H₁₆O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic acyclic ester
1 reference
inferred from
biogenic acyclic ester
mass
144.115029752
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₆O₂
0 references
canonical SMILES
O=C(OCCC)C(C)CC
0 references
found in taxon
Litsea glaucescens
1 reference
stated in
Litsea glaucescens Humb., Bonpl. & Kunth var.Glaucescens (Lauraceae): A Mexican bay
Artemisia annua
1 reference
stated in
Chemical Composition and Antipathogenic Activity of Artemisia annua Essential Oil from Romania.
Matricaria chamomilla
1 reference
stated in
Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants
Chamomilla recutita
1 reference
stated in
Propagation Method and Distillation Apparatus Type Affect Essential Oil from Different Parts of Matricaria recutita L. Plants
Humulus lupulus
1 reference
stated in
Characterization of Key Aroma Compounds in Pellets of Different Hop Varieties (Humulus lupulus L.) by Means of the Sensomics Approach
Durio zibethinus
1 reference
stated in
Sulfur-Containing Volatiles of Durian Fruits (Durio zibethinus Murr.)
Identifiers
InChI
InChI=1S/C8H16O2/c1-4-6-10-8(9)7(3)5-2/h7H,4-6H2,1-3H3
0 references
InChIKey
TZFQMSDUSOTCJC-UHFFFAOYSA-N
0 references
CAS Registry Number
37064-20-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
162239
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
TZFQMSDUSOTCJC-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL805650
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TZFQMSDUSOTCJC-UHFFFAOYSA-N
UniChem compound ID
23606908
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-Fac_Eng_Univ_Tokyo-JP007086
0 references
DSSTox substance ID
DTXSID90865847
1 reference
matched by identifier from
InChIKey
InChIKey
TZFQMSDUSOTCJC-UHFFFAOYSA-N
KNApSAcK ID
C00061633
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
TZFQMSDUSOTCJC-UHFFFAOYSA-N
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