| SpectraBase Spectrum ID |
Kse5qiVBSl1 |
| Name |
(4R)-(+)-(1,1-Dimethylethyl)-3-oxa-6-aza-2-boratricyclo[5.3.3.0(2,6)]tridecane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.210744630 u |
| Formula |
C14H26BNO |
| InChI |
InChI=1S/C14H26BNO/c1-14(2,3)13-10-16-12-8-4-6-11(7-5-9-12)15(16)17-13/h11-13H,4-10H2,1-3H3/t11-,12+,13-/m0/s1 |
| InChIKey |
FWCKIZIKGUCRSE-XQQFMLRXSA-N |
| Instrument Name |
Hewlett-Packard 5995A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.406 |
| Molecular Weight |
235.178 g/mol |
| Optical Rotation |
[a]D25 = +7.7 (c = 3.0, n-C6H14) |
| Quality |
92 |
| Reported Formula |
C14H26BNO |
| SMILES |
[C@]1(OB2N(C1)[C@]1(CCC[C@@]2(CCC1)[H])[H])(C(C)(C)C)[H] |
| SPLASH |
splash10-0a4i-2590000000-abb8f7ea7e94c55ac89f |
| Sample Comments |
10% ee |
| Source of Spectrum |
ARK-2001-53-9c (DOI: 10.3998/ark.5550190.0002.406) |
| Wiley ID |
1908743 |
![(4R)-(+)-(1,1-Dimethylethyl)-3-oxa-6-aza-2-boratricyclo[5.3.3.0(2,6)]tridecane](/api/spectrum/Kse5qiVBSl1/structure.png?h=300&w=458 "(4R)-(+)-(1,1-Dimethylethyl)-3-oxa-6-aza-2-boratricyclo[5.3.3.0(2,6)]tridecane")
