| SpectraBase Spectrum ID |
DaU0njMleMa |
| Name |
(1S,4R,5S,7S)-3-Cinnamyl-4-exo-benzyl-6,8-dioxa-7-exo-hydroxymethyl-3-azabicyclo[3.2.1]octane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO3 |
| InChI |
InChI=1S/C22H25NO3/c24-16-21-20-15-23(13-7-12-17-8-3-1-4-9-17)19(22(25-20)26-21)14-18-10-5-2-6-11-18/h1-12,19-22,24H,13-16H2/b12-7+/t19-,20+,21+,22+/m1/s1 |
| InChIKey |
MYAZJLNHWJFZRC-JMGCGFJISA-N |
| Molecular Weight |
351.446 g/mol |
| SMILES |
OC[C@@]1(O[C@@]2(O[C@]1(CN([C@@]2(Cc1ccccc1)[H])C\C=C\c1ccccc1)[H])[H])[H] |
| SPLASH |
splash10-014i-0900000000-eed08b7df4a6c142704d |
| Source of Spectrum |
QC-11-4234-16 |
| Wiley ID |
860177 |
![(1S,4R,5S,7S)-3-Cinnamyl-4-exo-benzyl-6,8-dioxa-7-exo-hydroxymethyl-3-azabicyclo[3.2.1]octane](/api/spectrum/DaU0njMleMa/structure.png?h=300&w=458 "(1S,4R,5S,7S)-3-Cinnamyl-4-exo-benzyl-6,8-dioxa-7-exo-hydroxymethyl-3-azabicyclo[3.2.1]octane")
