| SpectraBase Spectrum ID |
7Irekgmu4XE |
| Name |
Ethyl 2-bromo-3-[4-[2-[N-(2R/S)-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(2S)-pyrrolidine-2-methoxy]phenyl]propanoate |
| Alternate Name(s) |
2-bromo-3-[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-1-benzopyran-2-yl)methyl]-2-pyrrolidinyl]methoxy]phenyl]propanoic acid ethyl ester
ethyl 2-bromo-3-[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]propanoate
ethyl 3-[4-[[(2S)-1-[(6-benzyloxy-2,5,7,8-tetramethyl-chroman-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]-2-bromo-propanoate
ethyl 2-bromanyl-3-[4-[[(2S)-1-[(2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)methyl]pyrrolidin-2-yl]methoxy]phenyl]propanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H46BrNO5 |
| InChI |
InChI=1S/C37H46BrNO5/c1-6-41-36(40)33(38)21-28-14-16-31(17-15-28)42-23-30-13-10-20-39(30)24-37(5)19-18-32-27(4)34(25(2)26(3)35(32)44-37)43-22-29-11-8-7-9-12-29/h7-9,11-12,14-17,30,33H,6,10,13,18-24H2,1-5H3/t30-,33?,37?/m0/s1 |
| InChIKey |
JPNKLAROTTUHIH-HLVKXNDVSA-N |
| Molecular Weight |
664.681 g/mol |
| SMILES |
c12c(c(C)c(c(c2C)C)OCc2ccccc2)CCC(O1)(CN1[C@](COc2ccc(CC(C(=O)OCC)Br)cc2)(CCC1)[H])C |
| SPLASH |
splash10-0006-0090000000-f7fa3d707e9dcf6b2a0f |
| Source of Spectrum |
F2-42-3276-0 |
| Wiley ID |
1600264 |
![Ethyl 2-bromo-3-[4-[2-[N-(2R/S)-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(2S)-pyrrolidine-2-methoxy]phenyl]propanoate](/api/spectrum/7Irekgmu4XE/structure.png?h=300&w=458 "Ethyl 2-bromo-3-[4-[2-[N-(2R/S)-(6-Benzyloxy-2,5,7,8-tetramethylchroman-2-ylmethyl)-(2S)-pyrrolidine-2-methoxy]phenyl]propanoate")
