| SpectraBase Spectrum ID |
E1Fgx75u85N |
| Name |
Benzoic acid, 3-formyl-4-methoxy-2-pentyl-6-(phenylmethoxy)-, phenylmethyl ester |
| Alternate Name(s) |
benzyl 6-(benzyloxy)-3-formyl-4-methoxy-2-pentylbenzoate |
| CAS Registry Number |
124281-35-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H30O5 |
| InChI |
InChI=1S/C28H30O5/c1-3-4-7-16-23-24(18-29)25(31-2)17-26(32-19-21-12-8-5-9-13-21)27(23)28(30)33-20-22-14-10-6-11-15-22/h5-6,8-15,17-18H,3-4,7,16,19-20H2,1-2H3 |
| InChIKey |
RKJLDBZPEUKRRV-UHFFFAOYSA-N |
| Molecular Weight |
446.543 g/mol |
| SMILES |
c1(c(c(C=O)c(cc1OCc1ccccc1)OC)CCCCC)C(OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-2a8af6e68c40bf2a8a30 |
| Source of Spectrum |
B-42-992-12 |
| Wiley ID |
1386754 |
