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3-(4-(3-(3-Indolyl)-1-oxopropyl)phenyl)propyl 2,2-dimethylpropanoate
SpectraBase Compound ID 9fzXfOldYxg
InChI InChI=1S/C25H29NO3/c1-25(2,3)24(28)29-16-6-7-18-10-12-19(13-11-18)23(27)15-14-20-17-26-22-9-5-4-8-21(20)22/h4-5,8-13,17,26H,6-7,14-16H2,1-3H3
InChIKey ZIUUEOGZVPCNJK-UHFFFAOYSA-N
Mol Weight 391.51 g/mol
Molecular Formula C25H29NO3
Exact Mass 391.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yglGkK9m5l
Name 3-(4-(3-(3-Indolyl)-1-oxopropyl)phenyl)propyl 2,2-dimethylpropanoate
Alternate Name(s) 3-{4-[3-(1H-indol-3-yl)propanoyl]phenyl}propyl pivalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29NO3
InChI InChI=1S/C25H29NO3/c1-25(2,3)24(28)29-16-6-7-18-10-12-19(13-11-18)23(27)15-14-20-17-26-22-9-5-4-8-21(20)22/h4-5,8-13,17,26H,6-7,14-16H2,1-3H3
InChIKey ZIUUEOGZVPCNJK-UHFFFAOYSA-N
Molecular Weight 391.511 g/mol
SMILES [nH]1c2c(c(c1)CCC(c1ccc(cc1)CCCOC(C(C)(C)C)=O)=O)cccc2
SPLASH splash10-001l-0901000000-8a55f3df5c4ee1051337
Source of Spectrum F-55-12952-42
Wiley ID 839745