Dataset

4-TERPINYL ACETATE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006481 contains the MS mass spectrum of 4-TERPINYL ACETATE with the InChIkey BFCBRSFYYLSTAA-UHFFFAOYSA-N.

Chemical Information

molecular Image

InChI	InChI=1S/C12H20O2/c1-9(2)12(14-11(4)13)7-5-10(3)6-8-12/h5,9H,6-8H2,1-4H3
SMILES	CC(=O)OC(C1)(CC=C(C)C1)C(C)C
InChI Key	BFCBRSFYYLSTAA-UHFFFAOYSA-N
Molecular Formula	C12H20O2
Exact Mass	196.146 g/mol

Data and Resources

4-TERPINYL ACETATEHTML

Go to source

Related Molecule ⌄

(4-methyl-1-propan-2-ylcyclohex-3-en-1-yl) acetate

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP006481
Version
Author
Maintainer
Language
MetadataPublished	2016-01-19
Related Molecule	(4-methyl-1-propan-2-ylcyclohex-3-en-1-yl) acetate

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
SCHEMBL9951564	SureChEMBL
20777-48-4	ACToR
4821-04-9	ACToR
60021309	NMRShiftDB
184320	ChEBI
20960	PubChem
DTXSID90884114	EPA CompTox Dashboard
302N85584M	FDA SRS
J187.039D	Nikkaji
The data in this table is sourced from UniChem at EBI.