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(1a,3ab,5a,6a,7ab)-(-)-1,3a-dimethyl-6-(1-methylethyl)octahydro-1,5-methano-1H-inden-4-yl thiocyanate
SpectraBase Compound ID 1ms4JuTwxnO
InChI InChI=1S/C16H25NS/c1-10(2)11-7-13-15(3)5-6-16(13,4)14(18-9-17)12(11)8-15/h10-14H,5-8H2,1-4H3/t11-,12-,13+,14?,15+,16-/m0/s1
InChIKey PAPMPNGRDPJGLL-VKSCHZKKSA-N
Mol Weight 263.44 g/mol
Molecular Formula C16H25NS
Exact Mass 263.170771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4qiMbdUxirT
Name (1a,3ab,5a,6a,7ab)-(-)-1,3a-dimethyl-6-(1-methylethyl)octahydro-1,5-methano-1H-inden-4-yl thiocyanate
Alternate Name(s) (1R,3S,6R,7R,9S)-9-isopropyl-3,6-dimethyltricyclo[4.3.1.0(3,7)]dec-2-yl thiocyanate 1,3a-Dimethyl-6-(1'-methylethyl)octahydro-1,5-methano-1H-inden-4-yl thiocyanate 2-Thiocyanato-neopupukeanane
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Formula C16H25NS
InChI InChI=1S/C16H25NS/c1-10(2)11-7-13-15(3)5-6-16(13,4)14(18-9-17)12(11)8-15/h10-14H,5-8H2,1-4H3/t11-,12-,13+,14?,15+,16-/m0/s1
InChIKey PAPMPNGRDPJGLL-VKSCHZKKSA-N
Molecular Weight 263.443 g/mol
SMILES [C@@]12([C@]3([C@](C)(CC2)C[C@](C1SC#N)([C@](C(C)C)(C3)[H])[H])[H])C
SPLASH splash10-0a4i-5690000000-a2d12954c2df04f70b45
Source of Spectrum JA-50-1123-0
Wiley ID 1267103