| SpectraBase Spectrum ID |
1CBRDAnZBI |
| Name |
1(R),6(S)-Dimethyl-4(R)-isopropyl-1,2,3,4,7,8,9,10-octahydronaphthalene-1(R)thiocyanate |
| Alternate Name(s) |
Axinisothiocyanate J
(1R,4R,4aR,8aS)-4-isothiocyanato-4,7-dimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H25NS |
| InChI |
InChI=1S/C16H25NS/c1-11(2)13-7-8-16(4,17-10-18)15-6-5-12(3)9-14(13)15/h9,11,13-15H,5-8H2,1-4H3/t13-,14-,15-,16-/m1/s1 |
| InChIKey |
SRYJMNDTUAKSRD-KLHDSHLOSA-N |
| Molecular Weight |
263.443 g/mol |
| SMILES |
[C@]12([C@]([C@@](N=C=S)(C)CC[C@@]2(C(C)C)[H])(CCC(=C1)C)[H])[H] |
| SPLASH |
splash10-06xt-3950000000-a1940209d26f2f2fd00b |
| Source of Spectrum |
G4-71-613-11 |
| Wiley ID |
1694938 |
