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(Q72509084)
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English
(2E/Z)-2-methyl-2-butenal
pair of cis–trans isomers
2-methylcrotonaldehyde
2-methyl-2-butenal
2,3-dimethylacrolein
tiglic aldehyde
(E/Z)-tiglic aldehyde
2-methyl-crotonaldehyde
In more languages
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Statements
instance of
group of stereoisomers
0 references
subclass of
alkenal
0 references
biogenic acyclic aldehyde
1 reference
inferred from
biogenic acyclic aldehyde
mass
84.057514876
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₅H₈O
0 references
canonical SMILES
O=CC(=CC)C
0 references
found in taxon
Allium cepa
3 references
stated in
Identification of a new volatile compound in onion (Allium cepa) and leek (Allium porum): 3,4-dimethyl-2,5-dioxo-2,5-dihydrothiophene
stated in
Isolation and identification of phase II enzyme-inducing agents from nonpolar extracts of green onion (Allium spp.).
stated in
Chemical compositions and antioxidant/anti-inflammatory activities of steam distillate from freeze-dried onion ( Allium cepa L.) sprout
Aesculus hippocastanum
1 reference
stated in
Volatiles of Common Horsechestnut (Aesculus hippocastanumL.) (Hippocastanaceae) Blossoms
Allium ampeloprasum
1 reference
stated in
Volatile Compounds in Leek and Asafoetida
Coffea arabica
1 reference
stated in
New volatile components of roasted coffee
Angelica gigas
1 reference
stated in
Volatile organic compounds of Angelica gigas Nakai, Korean medicinal herb
Camellia sinensis
1 reference
stated in
Metabolite profiling of Camellia sinensis by automated sequential, multidimensional gas chromatography/mass spectrometry reveals strong monsoon effects on tea constituents
tomato
1 reference
stated in
Differentiation of the volatile profile of microbiologically contaminated canned tomatoes by dynamic headspace extraction followed by gas chromatography-mass spectrometry analysis
Chrysopogon zizanioides
1 reference
stated in
Headspace Constituents of Vetiver Oil
Identifiers
InChI
InChI=1S/C5H8O/c1-3-5(2)4-6/h3-4H,1-2H3
0 references
InChIKey
ACWQBUSCFPJUPN-UHFFFAOYSA-N
0 references
CAS Registry Number
1115-11-3
1 reference
stated in
CAS Common Chemistry
retrieved
31 December 2022
reference URL
https://commonchemistry.cas.org/detail?cas_rn=1115-11-3
InChIKey
ACWQBUSCFPJUPN-UHFFFAOYSA-N
based on heuristic
InChIKey match
ChemSpider ID
9912
0 references
PubChem CID
10336
1 reference
matched by identifier from
InChIKey
InChIKey
ACWQBUSCFPJUPN-UHFFFAOYSA-N
UniChem compound ID
26116469
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00859414
1 reference
matched by identifier from
InChIKey
InChIKey
ACWQBUSCFPJUPN-UHFFFAOYSA-N
FEMA number
3407
0 references
J-GLOBAL ID
200907041103944277
0 references
Nikkaji ID
J126.513J
0 references
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