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4-[2-[7,8-Dihydo-7-oxo-6H-pyrrolo[2,3-g]-1,2-benzisoxazol-3-yl]ethyl]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester

View entire compound with spectra: 1 MS (GC)

4-[2-[7,8-Dihydo-7-oxo-6H-pyrrolo[2,3-g]-1,2-benzisoxazol-3-yl]ethyl]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
SpectraBase Compound ID Er0aIEh3qXS
InChI InChI=1S/C21H27N3O4/c1-21(2,3)27-20(26)24-10-8-13(9-11-24)4-6-17-14-5-7-16-15(12-18(25)22-16)19(14)28-23-17/h5,7,13H,4,6,8-12H2,1-3H3,(H,22,25)
InChIKey RCQIJEUSJGTKPF-UHFFFAOYSA-N
Mol Weight 385.46 g/mol
Molecular Formula C21H27N3O4
Exact Mass 385.200156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZjqFI17Hpf
Name 4-[2-[7,8-Dihydo-7-oxo-6H-pyrrolo[2,3-g]-1,2-benzisoxazol-3-yl]ethyl]-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27N3O4
InChI InChI=1S/C21H27N3O4/c1-21(2,3)27-20(26)24-10-8-13(9-11-24)4-6-17-14-5-7-16-15(12-18(25)22-16)19(14)28-23-17/h5,7,13H,4,6,8-12H2,1-3H3,(H,22,25)
InChIKey RCQIJEUSJGTKPF-UHFFFAOYSA-N
Molecular Weight 385.464 g/mol
SMILES N1C(Cc2c1ccc1c(noc21)CCC1CCN(C(OC(C)(C)C)=O)CC1)=O
SPLASH splash10-0a4i-9003000000-287762e430fb535bf9e4
Source of Spectrum E1-38-2806-17
Wiley ID 1598488