SpectraBase Spectrum ID |
DnbFhi92L8U |
Name |
2H-Pyrrol-2-one, 1-acetyl-1,5-dihydro-3-(12-methyl-10,12-tetradecadienyl)-5-(phenylmethyl)-, [S-(E,E)]- |
CAS Registry Number |
123250-84-0 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H39NO2 |
InChI |
InChI=1S/C28H39NO2/c1-4-23(2)17-13-10-8-6-5-7-9-11-16-20-26-22-27(29(24(3)30)28(26)31)21-25-18-14-12-15-19-25/h4,12-15,17-19,22,27H,5-11,16,20-21H2,1-3H3/b17-13+,23-4+/t27-/m0/s1 |
InChIKey |
YUDFWTWNYLUJPJ-QZIWEMMVSA-N |
Molecular Weight |
421.625 g/mol |
SMILES |
C1(N([C@](C=C1CCCCCCCCC\C=C\C(=C\C)C)(Cc1ccccc1)[H])C(=O)C)=O |
SPLASH |
splash10-0006-9000000000-45667427a1af0136e356 |
Source of Spectrum |
KC-1989-493-13 |
Synonyms |
(5S)-1-acetyl-5-benzyl-3-[(10E,12E)-12-methyl-10,12-tetradecadienyl]-1,5-dihydro-2H-pyrrol-2-one
(5S,10'E,12'E)-1-acetyl-5-benzyl-3-(12'-methyltetradeca-10',12'-dienyl)pyrrol-2(5H)-one |
Wiley ID |
1378384 |