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Xylopine
SpectraBase Compound ID 2WO6kAqp4U4
InChI InChI=1S/C18H17NO3/c1-20-12-2-3-13-11(6-12)7-14-16-10(4-5-19-14)8-15-18(17(13)16)22-9-21-15/h2-3,6,8,14,19H,4-5,7,9H2,1H3/t14-/m1/s1
InChIKey RFWCCZDSXIZJMF-CQSZACIVSA-N
Mol Weight 295.34 g/mol
Molecular Formula C18H17NO3
Exact Mass 295.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6I5PiqLZCkL
Name (-)-Xylopine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO3
InChI InChI=1S/C18H17NO3/c1-20-12-2-3-13-11(6-12)7-14-16-10(4-5-19-14)8-15-18(17(13)16)22-9-21-15/h2-3,6,8,14,19H,4-5,7,9H2,1H3/t14-/m1/s1
InChIKey RFWCCZDSXIZJMF-CQSZACIVSA-N
Molecular Weight 295.338 g/mol
SMILES N1CCc2cc3c(c-4c2[C@]1(Cc1c4ccc(c1)OC)[H])OCO3
SPLASH splash10-0006-0090000000-e1d5b498a95268db76d1
Source of Spectrum QA-44-316-9
Synonyms (-)-Anolobine
Wiley ID 862470