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Intermedine
SpectraBase Compound ID 82PiaNPxXfS
InChI InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+/m1/s1
InChIKey SFVVQRJOGUKCEG-OPQSFPLASA-N
Mol Weight 299.37 g/mol
Molecular Formula C15H25NO5
Exact Mass 299.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nOiN5vwUMn
Name Intermedine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25NO5
InChI InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+/m1/s1
InChIKey SFVVQRJOGUKCEG-OPQSFPLASA-N
Literature Reference DOI 10.1002/pca.2608
Molecular Weight 299.367 g/mol
SMILES O[C@@]([C@@](C(=O)OCC1=CCN2[C@]1([C@@](CC2)(O)[H])[H])(O)C(C)C)(C)[H]
SPLASH splash10-000f-9700000000-c7ab6969b0776f5f3986
Source of Spectrum PA-27-137-4
Synonyms ((1R,7aR)-1-hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl (2S,3R)-2,3-dihydroxy-2-isopropylbutanoate
Wiley ID 1800204