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3-[(Z)-2-cyano-2-[3-(2-tetrahydropyran-2-yloxyethyl)-1H-indol-2-yl]vinyl]-3-ethyl-piperidine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID 33vGOAXT6tJ
InChI InChI=1S/C30H41N3O4/c1-5-30(15-10-16-33(21-30)28(34)37-29(2,3)4)19-22(20-31)27-24(23-11-6-7-12-25(23)32-27)14-18-36-26-13-8-9-17-35-26/h6-7,11-12,19,26,32H,5,8-10,13-18,21H2,1-4H3/b22-19+
InChIKey VVDAVZRLIOFVDH-ZBJSNUHESA-N
Mol Weight 507.7 g/mol
Molecular Formula C30H41N3O4
Exact Mass 507.309707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6D3txe4WzFZ
Name 3-[(Z)-2-cyano-2-[3-(2-tetrahydropyran-2-yloxyethyl)-1H-indol-2-yl]vinyl]-3-ethyl-piperidine-1-carboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H41N3O4
InChI InChI=1S/C30H41N3O4/c1-5-30(15-10-16-33(21-30)28(34)37-29(2,3)4)19-22(20-31)27-24(23-11-6-7-12-25(23)32-27)14-18-36-26-13-8-9-17-35-26/h6-7,11-12,19,26,32H,5,8-10,13-18,21H2,1-4H3/b22-19+
InChIKey VVDAVZRLIOFVDH-ZBJSNUHESA-N
Molecular Weight 507.675 g/mol
SMILES [nH]1c2ccccc2c(c1\C(=C\C1(CN(C(OC(C)(C)C)=O)CCC1)CC)C#N)CCOC1OCCCC1
SPLASH splash10-052r-9100000000-8d516959c5c6569a298c
Source of Spectrum D1-1994-718-6
Synonyms 3-[(Z)-2-cyano-2-[3-[2-(2-oxanyloxy)ethyl]-1H-indol-2-yl]ethenyl]-3-ethyl-1-piperidinecarboxylic acid tert-butyl ester tert-Butyl 3-[(Z)-2-cyano-2-[3-(2-tetrahydropyran-2-yloxyethyl)-1H-indol-2-yl]vinyl]-3-ethyl-piperidine-1-carboxylate tert-Butyl 3-[(Z)-2-cyano-2-[3-[2-(oxan-2-yloxy)ethyl]-1H-indol-2-yl]ethenyl]-3-ethyl-piperidine-1-carboxylate
Wiley ID 834555