| SpectraBase Spectrum ID |
Fco57kGi9QG |
| Name |
2-[(1-benzyl-5-carbethoxy-4-methyl-pyrrol-3-yl)methyl]benzoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H23NO4 |
| InChI |
InChI=1S/C23H23NO4/c1-3-28-23(27)21-16(2)19(13-18-11-7-8-12-20(18)22(25)26)15-24(21)14-17-9-5-4-6-10-17/h4-12,15H,3,13-14H2,1-2H3,(H,25,26) |
| InChIKey |
HDXHRRUXSKNZEW-UHFFFAOYSA-N |
| Molecular Weight |
377.440 g/mol |
| SMILES |
OC(c1c(Cc2c[n](c(c2C)C(=O)OCC)Cc2ccccc2)cccc1)=O |
| SPLASH |
splash10-0006-9002000000-f63768da242a585bb450 |
| Source of Spectrum |
Y-30-221-14 |
| Synonyms |
2-[(1-benzyl-5-ethoxycarbonyl-4-methyl-pyrrol-3-yl)methyl]benzoic acid
2-[[5-ethoxycarbonyl-4-methyl-1-(phenylmethyl)-3-pyrrolyl]methyl]benzoic acid
2-[[5-ethoxycarbonyl-4-methyl-1-(phenylmethyl)pyrrol-3-yl]methyl]benzoic acid |
| Wiley ID |
1358327 |
![2-[(1-benzyl-5-carbethoxy-4-methyl-pyrrol-3-yl)methyl]benzoic acid](/api/spectrum/Fco57kGi9QG/structure.png?h=300&w=458 "2-[(1-benzyl-5-carbethoxy-4-methyl-pyrrol-3-yl)methyl]benzoic acid")
