| SpectraBase Spectrum ID |
7eUZC5TGKPY |
| Name |
(1r,3r,5r,7r)-6'-Nitrospiro[adamantane-2,4'-chroman]-2'-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19NO4 |
| InChI |
InChI=1S/C18H19NO4/c20-17-9-18(12-4-10-3-11(6-12)7-13(18)5-10)15-8-14(19(21)22)1-2-16(15)23-17/h1-2,8,10-13H,3-7,9H2/t10-,11+,12-,13+,18- |
| InChIKey |
YDODFKAHAVINLH-FWMKEVEXSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1021/acs.joc.1c01887 |
| Molecular Weight |
313.353 g/mol |
| SMILES |
c1(cc2c(cc1)OC(CC21[C@]2(C[C@@]3(C[C@](C2)(C[C@]1(C3)[H])[H])[H])[H])=O)[N+](=O)[O-] |
| SPLASH |
splash10-01p2-1291000000-970e4adc7d9ab51193f6 |
| Source of Spectrum |
JOC-87-SM3-8g |
| Wiley ID |
1884182 |
![(1r,3r,5r,7r)-6'-Nitrospiro[adamantane-2,4'-chroman]-2'-one](/api/spectrum/7eUZC5TGKPY/structure.png?h=300&w=458 "(1r,3r,5r,7r)-6'-Nitrospiro[adamantane-2,4'-chroman]-2'-one")
