Dataset

6-HYDROXY-3,4-DIHYDRO-2-(3-ISOPROPYLAMINO-2-HYDROXYPROPYLOXY)ETHYL-2H-1-BENZOPYRAN

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010062 contains the MS mass spectrum of 6-HYDROXY-3,4-DIHYDRO-2-(3-ISOPROPYLAMINO-2-HYDROXYPROPYLOXY)ETHYL-2H-1-BENZOPYRAN with the InChIkey APMGJFMVYQXFIP-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H35NO4/c1-13(2)22-11-17(23)12-25-10-9-21(6)8-7-18-16(5)19(24)14(3)15(4)20(18)26-21/h13,17,22-24H,7-12H2,1-6H3
SMILES CC(C)NCC(O)COCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1
InChI Key APMGJFMVYQXFIP-UHFFFAOYSA-N
Molecular Formula C21H35NO4
Exact Mass 365.257 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-JP010062
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:57:08.917636
MetadataModified 2024-01-11T15:57:09.081724
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
101588437 PubChem
J354.684E Nikkaji
The data in this table is sourced from UniChem at EBI.