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1-(3-hydroxy-4-methoxyphenethyl)-3a,4,5,6-tetrahydro-1H-indol-2(3H)-one
SpectraBase Compound ID 7gZpJApJEqZ
InChI InChI=1S/C17H21NO3/c1-21-16-7-6-12(10-15(16)19)8-9-18-14-5-3-2-4-13(14)11-17(18)20/h5-7,10,13,19H,2-4,8-9,11H2,1H3
InChIKey BGYSBKZRKFGGOB-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cM2hOlPI0a
Name 1-(3-hydroxy-4-methoxyphenethyl)-3a,4,5,6-tetrahydro-1H-indol-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-21-16-7-6-12(10-15(16)19)8-9-18-14-5-3-2-4-13(14)11-17(18)20/h5-7,10,13,19H,2-4,8-9,11H2,1H3
InChIKey BGYSBKZRKFGGOB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19711040936
Molecular Weight 287.359 g/mol
SMILES Oc1c(ccc(CCN2C3=CCCCC3CC2=O)c1)OC
SPLASH splash10-0f79-0890000000-e8b9ad24f347f90bd288
Source of Spectrum K-104-2962-7
Synonyms 1-(3-hydroxy-4-methoxyphenethyl)-1,3,3a,4,5,6-hexahydro-2H-indol-2-one
Wiley ID 1793464