| SpectraBase Spectrum ID |
DVrwmgmAlga |
| Name |
rac-4-methyl-3-((3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazol-5-yl)benzoic acid methyl ester |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31NO3 |
| InChI |
InChI=1S/C21H31NO3/c1-13-8-9-15(19(23)24-7)10-16(13)21(5)11-14(2)18-17(12-21)20(3,4)25-22(18)6/h8-10,14,17-18H,11-12H2,1-7H3/t14-,17+,18+,21+/m0/s1 |
| InChIKey |
LTJKTJRWYJMJQE-QMLHBMHXSA-N |
| Instrument Name |
GCMS |
| Ionization Type |
EI |
| Molecular Weight |
345.483 g/mol |
| SMILES |
C(c1cc(c(cc1)C)[C@]1(C[C@@]2([C@](N(OC2(C)C)C)([C@](C1)(C)[H])[H])[H])C)(=O)OC |
| SPLASH |
splash10-004s-5933000000-1429dccfe8c8d68a176c |
| Source of Spectrum |
CN114761385A |
| Wiley ID |
1884396 |
![rac-4-methyl-3-((3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazol-5-yl)benzoic acid methyl ester](/api/spectrum/DVrwmgmAlga/structure.png?h=300&w=458 "rac-4-methyl-3-((3aR,5R,7S,7aR)-1,3,3,5,7-pentamethyloctahydrobenzo[c]isoxazol-5-yl)benzoic acid methyl ester")
