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3a-[6-(Hydroxymethyl)-1,3-benzodioxol-5-yl]-6-methoxy-1-methyl-2,3,3a,6,7,7a-hexahydro-1H-indol-3-ol
SpectraBase Compound ID EidmiT10Xjf
InChI InChI=1S/C18H23NO5/c1-19-8-17(21)18(4-3-12(22-2)6-16(18)19)13-7-15-14(23-10-24-15)5-11(13)9-20/h3-5,7,12,16-17,20-21H,6,8-10H2,1-2H3
InChIKey XEEPVFFWNATEGX-UHFFFAOYSA-N
Mol Weight 333.38 g/mol
Molecular Formula C18H23NO5
Exact Mass 333.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xF0maNiSOw
Name 3a-[6-(Hydroxymethyl)-1,3-benzodioxol-5-yl]-6-methoxy-1-methyl-2,3,3a,6,7,7a-hexahydro-1H-indol-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO5
InChI InChI=1S/C18H23NO5/c1-19-8-17(21)18(4-3-12(22-2)6-16(18)19)13-7-15-14(23-10-24-15)5-11(13)9-20/h3-5,7,12,16-17,20-21H,6,8-10H2,1-2H3
InChIKey XEEPVFFWNATEGX-UHFFFAOYSA-N
Molecular Weight 333.384 g/mol
SMILES OC1CN(C2CC(C=CC12c1c(CO)cc2c(c1)OCO2)OC)C
SPLASH splash10-0fkc-9411000000-b9e7c2a92bba5bd109dc
Source of Spectrum NP-11-9094-0
Synonyms Criwellinediol 3a-[6-(hydroxymethyl)-1,3-benzodioxol-5-yl]-6-methoxy-1-methyl-3,6,7,7a-tetrahydro-2H-indol-3-ol
Wiley ID 1109968