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Supinine
SpectraBase Compound ID DOQU80iBR2W
InChI InChI=1S/C15H25NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h6,10-11,13,17,19H,4-5,7-9H2,1-3H3/t11-,13+,15+/m1/s1
InChIKey DRVWTOSBCBKXOR-ZLDLUXBVSA-N
Mol Weight 283.37 g/mol
Molecular Formula C15H25NO4
Exact Mass 283.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EC2fW99Ftf1
Name Supinine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25NO4
InChI InChI=1S/C15H25NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h6,10-11,13,17,19H,4-5,7-9H2,1-3H3/t11-,13+,15+/m1/s1
InChIKey DRVWTOSBCBKXOR-ZLDLUXBVSA-N
Literature Reference DOI 10.1002/pca.2608
Molecular Weight 283.368 g/mol
SMILES O[C@@]([C@](C(=O)OCC1=CCN2[C@]1(CCC2)[H])(C(C)C)O)(C)[H]
SPLASH splash10-00di-0900000000-d99bfcfebf1aa3a793b3
Source of Spectrum PA-27-137-1
Synonyms ((S)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl)methyl (3R)-2,3-dihydroxy-2-isopropylbutanoate
Wiley ID 1800202