Molecule

1-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)ethanone

Chemical Information

13 Related Dataset(s) ⌄

4-ACETYL-6-TERT-BUTYL-1,1-DIMETHYLINDANE; EI-B; MS

Celestolide; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+

Celestolide; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+

Celestolide; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+

Celestolide; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+

Celestolide; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+

Celestolide; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: 10 eV; R=35000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: 20 eV; R=35000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: 30 eV; R=35000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: 40 eV; R=35000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+

Celestolide; LC-ESI-QTOF; MS2; CE: Ramp 19.6-29.4 eV; R=35000; [M+H]+

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol70553
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEMBL3188960	ChEMBL
TANSIK	CCDC
172483	ChEBI
J13.559C	Nikkaji
DTXSID9044536	EPA CompTox Dashboard
MCULE-7921984241	Mcule
CB5406038	ChemicalBook
61585	PubChem
ZINC000003881431	ZINC
HMDB0031867	Human Metabolome Database
E1HM68Q21P	FDA SRS
16387700	PubChem: Thomson Pharma
SCHEMBL112943	SureChEMBL
13171-00-1	ACToR
929931	eMolecules
The data in this table is sourced from UniChem at EBI.