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1H-Indole-3-carboxylic acid, 2-[(1-hydroxycyclohexyl)methyl]-5-methoxy-1-methyl-, ethyl ester
SpectraBase Compound ID 8HWRLvrc97J
InChI InChI=1S/C20H27NO4/c1-4-25-19(22)18-15-12-14(24-3)8-9-16(15)21(2)17(18)13-20(23)10-6-5-7-11-20/h8-9,12,23H,4-7,10-11,13H2,1-3H3
InChIKey WNWCXATXMBKTTF-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C20H27NO4
Exact Mass 345.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOcV74Owkpi
Name 1H-Indole-3-carboxylic acid, 2-[(1-hydroxycyclohexyl)methyl]-5-methoxy-1-methyl-, ethyl ester
CAS Registry Number 122946-67-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO4
InChI InChI=1S/C20H27NO4/c1-4-25-19(22)18-15-12-14(24-3)8-9-16(15)21(2)17(18)13-20(23)10-6-5-7-11-20/h8-9,12,23H,4-7,10-11,13H2,1-3H3
InChIKey WNWCXATXMBKTTF-UHFFFAOYSA-N
Molecular Weight 345.439 g/mol
SMILES OC1(Cc2c(c3c(ccc(c3)OC)[n]2C)C(=O)OCC)CCCCC1
SPLASH splash10-0002-0190000000-87965f3b9857996d7c57
Source of Spectrum J-54-4790-4
Synonyms Ethyl 2-[(1-hydroxycyclohexyl)methyl]-5-methoxy-1-methyl-1H-indole-3-carboxylate Ethyl 2-[(1-hydroxycyclohexyl)methyl]-5-methoxy-indole-3-carboxylate
Wiley ID 1338723