3-ethyl-3-hexene (Q83038028)

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chemical compound

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Language	Label	Description	Also known as
English	3-ethyl-3-hexene	chemical compound

Statements

instance of

type of chemical entity

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subclass of

biogenic aliphatic hydrocarbon

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mass

112.125200512 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₈H₁₆

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canonical SMILES

C(=C(CC)CC)CC

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found in taxon

Plakortis angulospiculatus

1 reference

stated in

Comparative Study on the Volatile Metabolites of Two Marine Sponge Species of the GenusPlakortis

Identifiers

InChI

InChI=1S/C8H16/c1-4-7-8(5-2)6-3/h7H,4-6H2,1-3H3

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InChIKey

AUJLDZJNMXNESO-UHFFFAOYSA-N

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CAS Registry Number

16789-51-8

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PubChem CID

140138

2 references

stated in

PubChem

retrieved

26 December 2021

inferred from

InChIKey

matched by identifier from

InChIKey

InChIKey

AUJLDZJNMXNESO-UHFFFAOYSA-N

UniChem compound ID

24475244

1 reference

stated in

UniChem

DSSTox substance ID

DTXSID70168424

1 reference

matched by identifier from

InChIKey

InChIKey

AUJLDZJNMXNESO-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID5090915

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