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Allylescaline
SpectraBase Compound ID 7i3kLqCCfcE
InChI InChI=1S/C13H19NO3/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3/h4,8-9H,1,5-7,14H2,2-3H3
InChIKey JNUAYHHGCXYBHX-UHFFFAOYSA-N
Mol Weight 237.3 g/mol
Molecular Formula C13H19NO3
Exact Mass 237.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7o0k4MnltiK
Name Allylescaline
Catalog Number 9001982
CAS Registry Number 39201-76-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO3
InChI InChI=1S/C13H19NO3/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3/h4,8-9H,1,5-7,14H2,2-3H3
InChIKey JNUAYHHGCXYBHX-UHFFFAOYSA-N
Molecular Weight 237.299 g/mol
SMILES NCCc1cc(c(c(c1)OC)OCC=C)OC
SPLASH splash10-014i-2900000000-96552549111907f427f5
Source of Spectrum CAY-2023-1397-0
Wiley ID 1889334