| SpectraBase Spectrum ID |
onBXKt9Xs |
| Name |
Brachystemidine B |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18N2O5 |
| InChI |
InChI=1S/C15H18N2O5/c1-20-13-5-4-12(18)17(13)14-10(6-8-21-14)9-22-15(19)11-3-2-7-16-11/h2-3,6-7,13-14,16H,4-5,8-9H2,1H3/t13?,14-/m1/s1 |
| InChIKey |
IDTBQXSKCCAGNA-ARLHGKGLSA-N |
| Instrument Name |
VG Auto Spec-3000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np010330c |
| Molecular Weight |
306.318 g/mol |
| Optical Rotation |
[a]D27 = -3.1 (c = 0.32, MeOH) |
| SMILES |
[nH]1c(ccc1)C(OCC1=CCO[C@]1(N1C(CCC1OC)=O)[H])=O |
| SPLASH |
splash10-0006-8900000000-ce1f7ee4155b446ba919 |
| Source of Spectrum |
G4-65-752-2 |
| Wiley ID |
1881116 |
