Dataset

mass spectrometry (MS)

Chemical Info

InChI	InChI=1S/C10H12Br2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-8H,1-2H3
SMILES	CC(c1ccc(cc1)C(Br)C)Br
InChI Key	SPHVUXIZEZXNPH-UHFFFAOYSA-N
Molecular Formula	C10H12Br2
Exact Mass	292.010 g/mol

Data and Resources

• mass spectrometry (MS)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/SPHVUXIZEZXNPH-UHFFFAOYSA-N/CHMO0000470
License URL
Source	https://www.chemotion-repository.net/inchikey/SPHVUXIZEZXNPH-UHFFFAOYSA-N/CHMO0000470
Version
Author	Isabelle Wessely
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T02:44:33.824658
MetadataModified	2024-09-07T17:23:28.199995
MetadataPublished	2020-03-22

Field	Value
Measurement Technique	mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
583543	PubChem
J2.205.151B	Nikkaji
SCHEMBL1415320	SureChEMBL
The data in this table is sourced from UniChem at EBI.