(Q105178945)

English

(4S)-3,3,6-trimethylhepta-1,5-dien-4-yl acetate

chemical compound

In more languages

Statements

type of chemical entity

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biogenic acyclic ester

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2,5,5-trimethylheptane monoterpenoid

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196.14632988 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₂H₂₀O₂

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canonical SMILES

O=C(OC(C=C(C)C)C(C=C)(C)C)C

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isomeric SMILES

C=CC(C)(C)[C@H](C=C(C)C)OC(C)=O

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Artemisia annua

1 reference

Studies on the Essential Oil of Artemisia annua L. I

Artemisia schimperi

1 reference

A nor-monoterpene from Artemisia schimperi

Thymus kosteletzkyanus

1 reference

The composition of the essential oils ofThymus marschallianus

Thymus marschallianus

1 reference

The composition of the essential oils ofThymus marschallianus

Thymus pulegioides

1 reference

The composition of the essential oils ofThymus marschallianus

Thymus pannonicus

1 reference

The composition of the essential oils ofThymus marschallianus

Identifiers

InChI=1S/C12H20O2/c1-7-12(5,6)11(8-9(2)3)14-10(4)13/h7-8,11H,1H2,2-6H3/t11-/m0/s1

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NGIKFWJEQGLTBM-NSHDSACASA-N

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CAS Registry Number

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

NGIKFWJEQGLTBM-NSHDSACASA-N

UniChem compound ID

1 reference

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

NGIKFWJEQGLTBM-NSHDSACASA-N

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