Dataset

3-BROMO-1-PROPYNE

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004271 contains the MS mass spectrum of 3-BROMO-1-PROPYNE with the InChIkey YORCIIVHUBAYBQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C3H3Br/c1-2-3-4/h1H,3H2
SMILES C#CCBr
InChI Key YORCIIVHUBAYBQ-UHFFFAOYSA-N
Molecular Formula C3H3Br
Exact Mass 117.942 g/mol

Data and Resources

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-JP004271
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:56:30.130985
MetadataModified 2024-01-11T15:56:30.283962
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
106-96-7 ACToR
517845 eMolecules
14867219 PubChem: Thomson Pharma
CB3162370 ChemicalBook
ZINC000001648237 ZINC
DTXSID3042340 EPA CompTox Dashboard
MCULE-7634822695 Mcule
SCHEMBL847 SureChEMBL
20181848 NMRShiftDB
F3H7ZXK9ZU FDA SRS
J5.054G Nikkaji
7842 PubChem
The data in this table is sourced from UniChem at EBI.