SpectraBase Spectrum ID |
6iMRcu40sYb |
Name |
trans/cis-1-Butyl-4-[(E)-1-ethyl-1-pentenyl]-3-[(E)-2-phenyl-1-ethenyl]-2-azetanone |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H31NO |
InChI |
InChI=1S/C22H31NO/c1-4-7-14-19(6-3)21-20(22(24)23(21)17-8-5-2)16-15-18-12-10-9-11-13-18/h9-16,20-21H,4-8,17H2,1-3H3/b16-15+,19-14+ |
InChIKey |
JQUOTJPYKJQSQW-XKMLCGDKSA-N |
Molecular Weight |
325.496 g/mol |
SMILES |
C1(C(=O)N(C1\C(=C\CCC)CC)CCCC)\C=C\c1ccccc1 |
SPLASH |
splash10-004i-0009000000-b41839ed61ee835b8f44 |
Source of Spectrum |
QB-21-543-0 |
Wiley ID |
860596 |