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1-(2-tert-Butyl-3a,6,6-trimethyl-3a,4,5,6-tetrahydropyrrolo[1,2-b]isoxazol-3-yl)but-3-en-1-ol isomer
SpectraBase Compound ID IaoNGoXB2Ts
InChI InChI=1S/C17H29NO2/c1-8-9-12(19)13-14(15(2,3)4)20-18-16(5,6)10-11-17(13,18)7/h8,12,19H,1,9-11H2,2-7H3
InChIKey DDMXYVFGCRYHCA-UHFFFAOYSA-N
Mol Weight 279.42 g/mol
Molecular Formula C17H29NO2
Exact Mass 279.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYYo9jeOqYP
Name 1-(2-tert-Butyl-3a,6,6-trimethyl-3a,4,5,6-tetrahydropyrrolo[1,2-b]isoxazol-3-yl)but-3-en-1-ol isomer
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Formula C17H29NO2
InChI InChI=1S/C17H29NO2/c1-8-9-12(19)13-14(15(2,3)4)20-18-16(5,6)10-11-17(13,18)7/h8,12,19H,1,9-11H2,2-7H3
InChIKey DDMXYVFGCRYHCA-UHFFFAOYSA-N
Molecular Weight 279.424 g/mol
SMILES OC(CC=C)C=1C2(N(OC1C(C)(C)C)C(CC2)(C)C)C
SPLASH splash10-03di-0390000000-70506df6bae4b28fa45b
Source of Spectrum KC-57-4352-9
Synonyms 1-(2-tert-butyl-3a,6,6-trimethyl-4,5-dihydropyrrolo[1,2-b]isoxazol-3-yl)-3-buten-1-ol 1-(2-tert-butyl-3a,6,6-trimethyl-4,5-dihydropyrrolo[1,2-b]isoxazol-3-yl)but-3-en-1-ol 1-(2-tert-butyl-3a,6,6-trimethyl-4,5-dihydropyrrolo[1,2-b][1,2]oxazol-3-yl)but-3-en-1-ol 1-(2-tert-butyl-3a,6,6-trimethyl-4,5-dihydropyrrol[1,2-b]isoxazol-3-yl)but-3-en-1-ol
Wiley ID 1624142