Dataset

Nalbuphine

This MassBank record with Accession MSBNK-Waters-WA001515 contains the MS mass spectrum of Nalbuphine with the InChIkey NETZHAKZCGBWSS-CEDHKZHLSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H27NO4/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12/h4-5,12,15-16,19,23-25H,1-3,6-11H2/t15-,16+,19-,20-,21+/m0/s1
SMILES C(C1)CC1CN(C6)C(C4)C(O)(C5)C(C6)(C(C(O)C5)2)c(c34)c(c(O)cc3)O2
InChI Key NETZHAKZCGBWSS-CEDHKZHLSA-N
Molecular Formula C21H27NO4
Exact Mass 357.194 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001515
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:50:32.090085
MetadataModified 2024-01-11T22:50:32.261796
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables