Dataset

heteronuclear single quantum coherence (HSQC)

Chemical Info

InChI	InChI=1S/C14H18O2Si/c1-17(2,3)11-8-12-4-6-13(7-5-12)14-15-9-10-16-14/h4-7,14H,9-10H2,1-3H3
SMILES	C[Si](C#Cc1ccc(cc1)C1OCCO1)(C)C
InChI Key	MBCAGEMZHOCCET-UHFFFAOYSA-N
Molecular Formula	C14H18O2Si
Exact Mass	246.377 g/mol

Data and Resources

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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/MBCAGEMZHOCCET-UHFFFAOYSA-N/CHMO0000604
License URL
Source	https://www.chemotion-repository.net/inchikey/MBCAGEMZHOCCET-UHFFFAOYSA-N/CHMO0000604
Version
Author	Simone Gräßle
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T08:20:43.485122
MetadataModified	2024-09-08T00:19:15.228336
MetadataPublished	2023-02-06

Field	Value
Measurement Technique	heteronuclear single quantum coherence
Measurement Variables

Data-Source Molecule ID	Data-Source
57612348	PubChem
SCHEMBL4018845	SureChEMBL
ZINC000201335226	ZINC
J3.062.262F	Nikkaji
The data in this table is sourced from UniChem at EBI.