Dataset

5-hydroxyculmorin

This MassBank record with Accession MSBNK-AAFC-AC000102 contains the MS2 mass spectrum of 5-hydroxyculmorin with the InChIkey XFKGEQRMYJCXFK-YTAGIEBCSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H26O3/c1-13(2)9(17)5-6-14(3)10-8(16)7-15(14,4)12(18)11(10)13/h8-12,16-18H,5-7H2,1-4H3/t8-,9-,10+,11+,12?,14-,15-/m1/s1
SMILES C[C@@]12CC[C@H](C([C@H]3[C@@H]1[C@@H](C[C@@]2(C3O)C)O)(C)C)O
InChI Key XFKGEQRMYJCXFK-YTAGIEBCSA-N
Molecular Formula C15H26O3
Exact Mass 254.188 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000102
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:22:32.701159
MetadataModified 2024-01-11T09:22:32.848605
MetadataPublished 2017-07-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
122706895 PubChem
The data in this table is sourced from UniChem at EBI.