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compound 6.roesy

URL: https://nmrxiv.org/D1977

Dataset description:

This dataset contains NMR spectra obtained for the sample -compound 6 date: 2020-11-18T14:47:16.000Z isFt: false name: compound 6/1 phc0: -44.55221 phc1: -17.59124 type: NMR FID DECIM:...

Source: compound 6.roesy

Chemical Info

InChI	InChI=1S/C31H52O3/c1-19(2)31(18-34-31)17-24(32)20(3)21-11-15-30(8)23-9-10-25-27(4,5)26(33)13-14-28(25,6)22(23)12-16-29(21,30)7/h19-21,24-26,32-33H,9-18H2,1-8H3/t20?,21?,24?,25?,26-,28+,29+,30-,31?/m0/s1
SMILES	CC(C(O)CC1(C(C)C)CO1)C1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3
InChI Key	LUBCKPIVYMNDDL-HVJYTMGZSA-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	cbf5542a-5c89-4357-a58e-57b3555628bf
Package id	nmrxiv-d1977
Resource type	HTML
State	active