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English
3-methyl-3-butenyl butanoate
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
156.115029752
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₉H₁₆O₂
0 references
canonical SMILES
CCCC(=O)OCCC(=C)C
0 references
Identifiers
InChI
InChI=1S/C9H16O2/c1-4-5-9(10)11-7-6-8(2)3/h2,4-7H2,1,3H3
0 references
InChIKey
QXWHISNFDZLFAV-UHFFFAOYSA-N
0 references
CAS Registry Number
54702-13-5
0 references
PubChem CID
6429316
1 reference
matched by identifier from
InChIKey
InChIKey
QXWHISNFDZLFAV-UHFFFAOYSA-N
UniChem compound ID
25899017
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00423912
1 reference
matched by identifier from
InChIKey
InChIKey
QXWHISNFDZLFAV-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20374750
0 references
FL number
09.897
1 reference
quotation
CAS no.: 54702-13-5
(English)
stated in
EFSA database
retrieved
23 January 2021
FL number
09.897
UNII
E24U5Z23L8
1 reference
matched by identifier from
InChIKey
InChIKey
QXWHISNFDZLFAV-UHFFFAOYSA-N
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