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(R)-3-(4-tert-Butyl-phenyl)-2-((R)-2-methoxymethyl-pyrrolidin-1-yl)-2,3-dihydro-isoindol-1-one
SpectraBase Compound ID AEJRrUSph
InChI InChI=1S/C24H30N2O2/c1-24(2,3)18-13-11-17(12-14-18)22-20-9-5-6-10-21(20)23(27)26(22)25-15-7-8-19(25)16-28-4/h5-6,9-14,19,22H,7-8,15-16H2,1-4H3/t19-,22-/m1/s1
InChIKey IQFUQGSMEJQALL-DENIHFKCSA-N
Mol Weight 378.52 g/mol
Molecular Formula C24H30N2O2
Exact Mass 378.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fe6zXEWT1E
Name (R)-3-(4-tert-Butyl-phenyl)-2-((R)-2-methoxymethyl-pyrrolidin-1-yl)-2,3-dihydro-isoindol-1-one
Alternate Name(s) (3R)-3-(4-tert-butylphenyl)-2-[(2R)-2-(methoxymethyl)pyrrolidinyl]-2,3-dihydro-1H-isoindol-1-one 2-[2'-(Methoxymethyl)pyrrolidin-1'-yl]-3-(4''-t-butylphenyl)-2,3-dihydro-1H-isoindol-1-one 2-[2-(Methoxymethyl)pyrrolidin-1-yl]-3-(4-t-butylphenyl)-2,3-dihydro-1H-isoindol-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30N2O2
InChI InChI=1S/C24H30N2O2/c1-24(2,3)18-13-11-17(12-14-18)22-20-9-5-6-10-21(20)23(27)26(22)25-15-7-8-19(25)16-28-4/h5-6,9-14,19,22H,7-8,15-16H2,1-4H3/t19-,22-/m1/s1
InChIKey IQFUQGSMEJQALL-DENIHFKCSA-N
Molecular Weight 378.516 g/mol
SMILES C1(N([C@@](c2ccccc12)(c1ccc(C(C)(C)C)cc1)[H])N1[C@@](COC)(CCC1)[H])=O
SPLASH splash10-001i-0009000000-211cde09c53602d827fe
Source of Spectrum I-79-1531-13
Wiley ID 813036