Molecule

(3-acetyloxy-5-methylphenyl) acetate

Chemical Information

Molecular Image

InChI	InChI=1S/C11H12O4/c1-7-4-10(14-8(2)12)6-11(5-7)15-9(3)13/h4-6H,1-3H3
SMILES	CC(=O)Oc1cc(OC(=O)C)cc(c1)C
InChI Key	KDOYCAADBINREP-UHFFFAOYSA-N
Exact Mass	208.211 g/mol

18 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

correlation spectroscopy (COSY)

correlation spectroscopy (COSY)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

heteronuclear multiple bond coherence (HMBC)

heteronuclear multiple bond coherence (HMBC)

heteronuclear single quantum coherence (HSQC)

heteronuclear single quantum coherence (HSQC)

infrared absorption spectroscopy (IR)

infrared absorption spectroscopy (IR)

mass spectrometry (MS)

mass spectrometry (MS)

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol2237
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
1701666	surechembl
13886888	pubchem
The data in this table is sourced from UniChem at EBI.