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8-Bromanyl-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)octanamide
SpectraBase Compound ID Dmqz3qdPeN
InChI InChI=1S/C25H31BrN2O/c26-17-10-3-1-2-7-15-25(29)28(20-21-11-5-4-6-12-21)18-16-22-19-27-24-14-9-8-13-23(22)24/h4-6,8-9,11-14,19,27H,1-3,7,10,15-18,20H2
InChIKey UPBLNXWMVBBTIR-UHFFFAOYSA-N
Mol Weight 455.44 g/mol
Molecular Formula C25H31BrN2O
Exact Mass 454.161977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9k48eov35U
Name 8-Bromanyl-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)octanamide
Alternate Name(s) 8-Bromo-N-[2-(1H-indol-3-yl)ethyl]-N-(phenylmethyl)octanamide N-benzyl-8-bromo-N-[2-(1H-indol-3-yl)ethyl]caprylamide N-benzyl-8-bromo-N-[2-(1H-indol-3-yl)ethyl]octanamide
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Formula C25H31BrN2O
InChI InChI=1S/C25H31BrN2O/c26-17-10-3-1-2-7-15-25(29)28(20-21-11-5-4-6-12-21)18-16-22-19-27-24-14-9-8-13-23(22)24/h4-6,8-9,11-14,19,27H,1-3,7,10,15-18,20H2
InChIKey UPBLNXWMVBBTIR-UHFFFAOYSA-N
Molecular Weight 455.440 g/mol
SMILES [nH]1c2c(c(c1)CCN(C(=O)CCCCCCCBr)Cc1ccccc1)cccc2
SPLASH splash10-007o-0900000000-63af68f918c943582512
Source of Spectrum SO-0-1695-7
Wiley ID 878611