| SpectraBase Spectrum ID |
EesblFUmQf |
| Name |
(4S,1'R)-2-[4-[N-(2,4,6-Trimethoxybenzyl)-N-(2'-hydroxy-1'-phenylethyl)amino]heptyn-5-yl]-1,3-dioxolane |
| Alternate Name(s) |
2-[{(1S)-1-[1-(1,3-dioxolan-2-yl)propyl]-3-butynyl}(2,4,6-trimethoxybenzyl)amino]-2-phenylethanol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H37NO6 |
| InChI |
InChI=1S/C28H37NO6/c1-6-11-24(22(7-2)28-34-14-15-35-28)29(25(19-30)20-12-9-8-10-13-20)18-23-26(32-4)16-21(31-3)17-27(23)33-5/h1,8-10,12-13,16-17,22,24-25,28,30H,7,11,14-15,18-19H2,2-5H3/t22?,24-,25?/m0/s1 |
| InChIKey |
RLXHGUWQRQFKPO-JYNIAERNSA-N |
| Molecular Weight |
483.605 g/mol |
| SMILES |
OCC(N(Cc1c(cc(cc1OC)OC)OC)[C@](C(C1OCCO1)CC)(CC#C)[H])c1ccccc1 |
| SPLASH |
splash10-0f89-0900400000-91b812e84ea59a5e5d7c |
| Source of Spectrum |
J-63-2714-7 |
| Wiley ID |
1395855 |
![(4S,1'R)-2-[4-[N-(2,4,6-Trimethoxybenzyl)-N-(2'-hydroxy-1'-phenylethyl)amino]heptyn-5-yl]-1,3-dioxolane](/api/spectrum/EesblFUmQf/structure.png?h=300&w=458 "(4S,1'R)-2-[4-[N-(2,4,6-Trimethoxybenzyl)-N-(2'-hydroxy-1'-phenylethyl)amino]heptyn-5-yl]-1,3-dioxolane")
