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compound 5.roesy

URL: https://nmrxiv.org/D1995

Dataset description:

This dataset contains NMR spectra obtained for the sample -compound 5 date: 2020-11-30T17:14:05.000Z isFt: false name: compound 5/1 phc0: 190.6777 phc1: -20.98698 type: NMR FID DECIM:...

Source: compound 5.roesy

Chemical Info

InChI	InChI=1S/C30H50O3/c1-18(2)23(31)17-24(32)19(3)20-11-15-30(8)22-9-10-25-27(4,5)26(33)13-14-28(25,6)21(22)12-16-29(20,30)7/h18-20,24-26,32-33H,9-17H2,1-8H3/t19?,20?,24-,25?,26-,28+,29+,30-/m0/s1
SMILES	CC(C)C(=O)C[C@H](O)C(C)C1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
InChI Key	DRUBPRLFNHWRMP-FVCGGGHDSA-N

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Additional Information

Field	Value
Data last updated	May 15, 2024
Metadata last updated	May 15, 2024
Created	May 15, 2024
Format	HTML
License	No License Provided
Id	2910b9ab-50f5-45bf-8beb-99e304ccb6dd
Package id	nmrxiv-d1995
Resource type	HTML
State	active