| SpectraBase Spectrum ID |
LUVd5cIOoPf |
| Name |
1,6(R)-Dimethyl-4-isopropyl-5,6(S)-dihydroxy-1,2,3,4,6,7,8,9-octahydronaphthalene-1(R / S)-isothiocyanate |
| Alternate Name(s) |
Axinisothiocyanate E
(1S,4S,4aR,7S)-4-isothiocyanato-4,7-dimethyl-1-propan-2-yl-3,4a,5,6-tetrahydro-2H-naphthalene-1,7-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H25NO2S |
| InChI |
InChI=1S/C16H25NO2S/c1-11(2)16(19)8-7-15(4,17-10-20)12-5-6-14(3,18)9-13(12)16/h9,11-12,18-19H,5-8H2,1-4H3/t12-,14+,15+,16+/m1/s1 |
| InChIKey |
ZUDSVIIZJCRBTA-OEAJRASXSA-N |
| Molecular Weight |
295.441 g/mol |
| SMILES |
O[C@]1(CC[C@@]2(C([C@](CC[C@@]2(N=C=S)C)(C(C)C)O)=C1)[H])C |
| SPLASH |
splash10-004i-0940000000-d38626134507b1339e6d |
| Source of Spectrum |
G4-71-613-5 |
| Wiley ID |
1694943 |
