SpectraBase Spectrum ID |
FiWXz8RXKQF |
Name |
Methyl (2E,4E)-5-(benzo[b]thiophen-2-yl)-4-(2-hydroxyphenyl)hexa-2,4-dienoate |
Appearance |
Yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.097665611 u |
Formula |
C21H18O3S |
InChI |
InChI=1S/C21H18O3S/c1-14(20-13-15-7-3-6-10-19(15)25-20)16(11-12-21(23)24-2)17-8-4-5-9-18(17)22/h3-13,22H,1-2H3/b12-11+,16-14+ |
InChIKey |
ATBCMGPCEYCJNY-SIDAKMONSA-N |
Instrument Name |
Finnigan MAT 8200 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201803360 |
Molecular Weight |
350.432 g/mol |
Quality |
431 |
Reported Formula |
C21H18O3S |
SMILES |
OC1=C(\C(\C=C\C(OC)=O)=C/(C)C2=CC3=C(S2)C=CC=C3)C=CC=C1 |
SPLASH |
splash10-0f6x-0195000000-eab9d8c2f02edf1d7b54 |
Source of Spectrum |
QE-24-SM9-40i (DOI: 10.1002/chem.201803360) |
Wiley ID |
1901837 |