#StructureElucidation

@nmrspectroscopy.bsky.social

5 days ago

Combined, these two factors leave no doubt about the regioselectivity of the alkylation. Did the J values lead you to the right answer, or did you rely on the CH2 shift? Let’s discuss in the comments! 👇
#NMR #spectroscopy #chemistry #organicchemistry #regioselectivity #structureelucidation

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Bright Giant

@brightgiant.bsky.social

5 months ago

In this #NonTargetedAnalysis utilizing SIRIUS, researcher successfully identify common and previously unreported chemical contaminants in human milk, including novel parabens.

Blog post: buff.ly/0vQizvG
Paper: buff.ly/Mg8axQF

#SIRIUS6 #StructureElucidation

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Bright Giant

@brightgiant.bsky.social

7 months ago

Explore the new features and elevate your mass spectrometry data analysis.
⬇️ Learn more and download SIRIUS v6.3 today: lnkd.in/ejcaedSw

#SIRIUS6 #SIRIUSUpdate #MassSpectrometry #MSsoftware #LCMSMS #SmallMoleculeIdentification #StructureElucidation #Biotransformation #MachineLearning

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Bright Giant

@brightgiant.bsky.social

7 months ago

Test your #SIRIUS6 knowledge! 🧠

❓ The SIRIUS software uses an ILP solver to perform which specific task ❓
Drop a comment with your answer! The correct answer will be revealed on Friday.

Learn more about #SIRIUSSoftware: buff.ly/vBOiq3F

#SmallMoleculeID #StructureElucidation

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Bright Giant

@brightgiant.bsky.social

11 months ago

A picture of Baltimore with a call to meet us at ASMS 2025 at Baltimore Convention Center in Maryland on 01.-05. June 2025 at Booth 208. The Bright Giant logo and the hashtag SIRIUSEvents.

🚨 Join us at #ASMS2025! 🚨

Catch us at Booth 208 to see SIRIUS in action — our all-in-one software for #AI -driven #StructureElucidation of #SmallMolecules.

Let’s connect, talk science, and push the boundaries of small molecule analysis.

More updates soon 👀

#SIRIUSEvents #MassSpectrometry

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NL Institute of Ecology NIOO-KNAW

@niooknaw.bsky.social

2 years ago

Unravelling key enzymatic steps in C-ring cleavage during... Angucyclines are a class of natural products that harbor ...

New publication: Unravelling key enzymatic steps in C-ring cleavage during angucycline biosynthesis, by @GillesvanWezel and others. #massspectrometry #antibiotics #naturalproducts #oxidoreductases #structureelucidation
https://doi.org/10.1038/s42004-023-01059-1

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Timo Niedermeyer

@niedermeyer-lab.bsky.social

5 years ago

I offered my help in cultivation of the cyano strain, isolation and #StructureElucidation, and Susan was happy to accept my support. We were unable to get funding for this project (over the years, we tried three times!), but decided to go forward on our own expenses. 6/

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Posts tagged #StructureElucidation