Dataset

high-resolution mass spectrometry (HRMS)

Chemical Info

InChI	InChI=1S/C11H13BrO3/c1-4-15-11(13)8-5-7(2)10(12)9(6-8)14-3/h5-6H,4H2,1-3H3
SMILES	CCOC(=O)c1cc(C)c(c(c1)OC)Br
InChI Key	BUQPHXBXKAGZRZ-UHFFFAOYSA-N
Molecular Formula	C11H13BrO3
Exact Mass	273.123 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/BUQPHXBXKAGZRZ-UHFFFAOYSA-N/CHMO0000498
License URL
Source	https://www.chemotion-repository.net/inchikey/BUQPHXBXKAGZRZ-UHFFFAOYSA-N/CHMO0000498
Version
Author	Tobias Sengpiel
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-08T03:05:19.186174
MetadataModified	2024-09-08T03:05:19.186181
MetadataPublished	2024-02-23

Field	Value
Measurement Technique	high-resolution mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.