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(2S,3R)-3-tert-Butyl-2-(2-methoxymethylpyrrolidin-1-yl)-2,3-dihydro-1H-isoindol-1-one
SpectraBase Compound ID FtU7rHjy5NR
InChI InChI=1S/C18H26N2O2/c1-18(2,3)16-14-9-5-6-10-15(14)17(21)20(16)19-11-7-8-13(19)12-22-4/h5-6,9-10,13,16H,7-8,11-12H2,1-4H3/t13-,16-/m0/s1
InChIKey GBWOSBXSJMGVBR-BBRMVZONSA-N
Mol Weight 302.42 g/mol
Molecular Formula C18H26N2O2
Exact Mass 302.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXWU8htaW8Z
Name (2S,3R)-3-tert-Butyl-2-(2-methoxymethylpyrrolidin-1-yl)-2,3-dihydro-1H-isoindol-1-one
Alternate Name(s) (3R)-3-tert-butyl-2-[(2S)-2-(methoxymethyl)pyrrolidinyl]-2,3-dihydro-1H-isoindol-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26N2O2
InChI InChI=1S/C18H26N2O2/c1-18(2,3)16-14-9-5-6-10-15(14)17(21)20(16)19-11-7-8-13(19)12-22-4/h5-6,9-10,13,16H,7-8,11-12H2,1-4H3/t13-,16-/m0/s1
InChIKey GBWOSBXSJMGVBR-BBRMVZONSA-N
Molecular Weight 302.418 g/mol
SMILES C1(N([C@@](c2ccccc12)(C(C)(C)C)[H])N1[C@](COC)(CCC1)[H])=O
SPLASH splash10-0a5d-1930000000-8070fa5f70f8347a17c4
Source of Spectrum KD-14-2256-13
Wiley ID 1636217