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(1S*,2R*,3aR*)-2-Benzyltetrahydro-6',6'-dimethylspiro[cyclobutane-1,2'(3'H)-pyrrolo[1,2-b]isoxazole]
SpectraBase Compound ID CNPFHkofjR8
InChI InChI=1S/C18H25NO/c1-17(2)10-9-16-13-18(20-19(16)17)11-8-15(18)12-14-6-4-3-5-7-14/h3-7,15-16H,8-13H2,1-2H3/t15-,16-,18+/m1/s1
InChIKey LSAHWYGXMSJZSG-NUJGCVRESA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ThpXrIuPo
Name (1S*,2R*,3aR*)-2-Benzyltetrahydro-6',6'-dimethylspiro[cyclobutane-1,2'(3'H)-pyrrolo[1,2-b]isoxazole]
Alternate Name(s) (1S,2R,3'aR)-2-benzyl-6',6'-dimethyl-tetrahydro-3'H-spiro[cyclobutane-1,2'-pyrrolo[1,2-b][1,2]oxazole]
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Formula C18H25NO
InChI InChI=1S/C18H25NO/c1-17(2)10-9-16-13-18(20-19(16)17)11-8-15(18)12-14-6-4-3-5-7-14/h3-7,15-16H,8-13H2,1-2H3/t15-,16-,18+/m1/s1
InChIKey LSAHWYGXMSJZSG-NUJGCVRESA-N
Molecular Weight 271.404 g/mol
SMILES [C@@]12(ON3[C@@](C2)(CCC3(C)C)[H])[C@@](Cc2ccccc2)(CC1)[H]
SPLASH splash10-03dm-9600000000-3fb9b16f32f02bd2aaf8
Source of Spectrum F-48-5295-19
Wiley ID 1275519