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CSORODOCARPINE-A

View entire compound with spectra: 1 NMR, and 1 MS (GC)

CSORODOCARPINE-A
SpectraBase Compound ID 7B3Xb9KOCAU
InChI InChI=1S/C32H54N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(36)33-25-24-28-27-34-31-23-22-29(35)26-30(28)31/h22-23,26-27,34-35H,2-21,24-25H2,1H3,(H,33,36)
InChIKey XNISEOLHGQOJHH-UHFFFAOYSA-N
Mol Weight 498.8 g/mol
Molecular Formula C32H54N2O2
Exact Mass 498.418529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6whYJFwm98X
Name N-[2-(5-Hydroxy-1H-indol-3-yl)ethyl]docosanamide
Alternate Name(s) N-Behenoyl-5-hydroxytryptamine N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]behenamide N-[2-(5-oxidanyl-1H-indol-3-yl)ethyl]docosanamide
CAS Registry Number 21249-35-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H54N2O2
InChI InChI=1S/C32H54N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(36)33-25-24-28-27-34-31-23-22-29(35)26-30(28)31/h22-23,26-27,34-35H,2-21,24-25H2,1H3,(H,33,36)
InChIKey XNISEOLHGQOJHH-UHFFFAOYSA-N
Molecular Weight 498.796 g/mol
SMILES [nH]1c2ccc(cc2c(CCNC(CCCCCCCCCCCCCCCCCCCCC)=O)c1)O
SPLASH splash10-0a4i-0900000000-9796d7fbfcce8f11fb4a
Source of Spectrum W5-1989-8665-1
Wiley ID 1398658