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(1R,6S,7S)-7-Hexyl-6-aza-tricyclo[8.4.0.0*1,6*]tetradec-4-en-9-one
SpectraBase Compound ID GQ5vXzwQdYb
InChI InChI=1S/C19H31NO/c1-2-3-4-5-10-16-15-18(21)17-11-6-7-12-19(17)13-8-9-14-20(16)19/h9,14,16-17H,2-8,10-13,15H2,1H3/t16-,17?,19+/m0/s1
InChIKey ZKLWDLAJPFCFQU-LVLJQFTKSA-N
Mol Weight 289.46 g/mol
Molecular Formula C19H31NO
Exact Mass 289.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABZBGUTKeY9
Name (1R,6S,7S)-7-Hexyl-6-aza-tricyclo[8.4.0.0*1,6*]tetradec-4-en-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31NO
InChI InChI=1S/C19H31NO/c1-2-3-4-5-10-16-15-18(21)17-11-6-7-12-19(17)13-8-9-14-20(16)19/h9,14,16-17H,2-8,10-13,15H2,1H3/t16-,17?,19+/m0/s1
InChIKey ZKLWDLAJPFCFQU-LVLJQFTKSA-N
Molecular Weight 289.463 g/mol
SMILES [C@@]123N([C@](CC(C3CCCC1)=O)(CCCCCC)[H])C=CCC2
SPLASH splash10-0udi-0090000000-9be04b3e2cf3a54fc2c4
Source of Spectrum B-47-1361-8
Synonyms (1R,6S,7S)-7-Hexyl-6-aza-tricyclo[8.4.0.0*1,6*]tetradec-4-en-9-one
Wiley ID 1292901