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N-butanoyl-2-(1-guaiazulenyl)ethanamine
SpectraBase Compound ID J0O85esixQW
InChI InChI=1S/C21H29NO/c1-6-7-20(23)22-13-12-21(5)11-10-18-16(4)8-9-17(15(2)3)14-19(18)21/h8-11,14,18H,2,6-7,12-13H2,1,3-5H3,(H,22,23)
InChIKey LZCOOKIBFUVDPZ-UHFFFAOYSA-N
Mol Weight 311.47 g/mol
Molecular Formula C21H29NO
Exact Mass 311.224915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Se64yBhwmM
Name N-butanoyl-2-(1-guaiazulenyl)ethanamine
Alternate Name(s) N-[2-(7-isopropenyl-1,4-dimethyl-1,3a-dihydro-1-azulenyl)ethyl]butanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO
InChI InChI=1S/C21H29NO/c1-6-7-20(23)22-13-12-21(5)11-10-18-16(4)8-9-17(15(2)3)14-19(18)21/h8-11,14,18H,2,6-7,12-13H2,1,3-5H3,(H,22,23)
InChIKey LZCOOKIBFUVDPZ-UHFFFAOYSA-N
Molecular Weight 311.469 g/mol
SMILES N(C(=O)CCC)CCC1(C2=CC(=CC=C(C2C=C1)C)C(=C)C)C
SPLASH splash10-03di-0091000000-b8b1b7c5e4948c57e5bc
Source of Spectrum AJ-56-2061-8
Wiley ID 1312719