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Nor-Pachyconfine
SpectraBase Compound ID 2v4lwZzJNjc
InChI InChI=1S/C17H17NO3/c1-21-17-12(19)8-9-6-7-18-15-13(9)14(17)10-4-2-3-5-11(10)16(15)20/h2-5,8,15-16,18-20H,6-7H2,1H3/t15-,16-/m0/s1
InChIKey QDXOCDFPAQQYKD-HOTGVXAUSA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Pe9Gg7ayL0
Name Nor-Pachyconfine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-21-17-12(19)8-9-6-7-18-15-13(9)14(17)10-4-2-3-5-11(10)16(15)20/h2-5,8,15-16,18-20H,6-7H2,1H3/t15-,16-/m0/s1
InChIKey QDXOCDFPAQQYKD-HOTGVXAUSA-N
Molecular Weight 283.327 g/mol
SMILES N1CCc2cc(c(c-3c2[C@]1([C@](c1ccccc31)(O)[H])[H])OC)O
SPLASH splash10-001i-0090000000-c6589a391164a255d40f
Source of Spectrum QA-46-609-9
Synonyms (-)-Asimilobine
Wiley ID 863240