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1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-3-(2-methoxycyclohexyl)-2-methyl-
SpectraBase Compound ID GyCdaMhHDWD
InChI InChI=1S/C16H21NO3/c1-17-15(18)11-7-3-4-8-12(11)16(17,19)13-9-5-6-10-14(13)20-2/h3-4,7-8,13-14,19H,5-6,9-10H2,1-2H3
InChIKey FHRFNATUZOGZKB-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqKlE4uFJDV
Name 1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-3-(2-methoxycyclohexyl)-2-methyl-
CAS Registry Number 70113-69-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-17-15(18)11-7-3-4-8-12(11)16(17,19)13-9-5-6-10-14(13)20-2/h3-4,7-8,13-14,19H,5-6,9-10H2,1-2H3
InChIKey FHRFNATUZOGZKB-UHFFFAOYSA-N
Molecular Weight 275.348 g/mol
SMILES OC1(N(C(=O)c2c1cccc2)C)C1C(OC)CCCC1
SPLASH splash10-03di-3900000000-7ed0dd1bcccf588c099b
Source of Spectrum J-50-2683-4
Synonyms 3-Hydroxy-3-(2-methoxycyclohexyl)-2-methyl-1-isoindolinone 3-Hydroxy-3-(2-methoxycyclohexyl)-2-methylisoindolin-1-one, diastereomer A 3-Hydroxy-3-(2-methoxycyclohexyl)-2-methylisoindolin-1-one, diastereomer B
Wiley ID 1279186