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(3a,7a-trans)-octahydro-3-(t-butyl)-2-phenylbenzoxazole
SpectraBase Compound ID 4gMz2Fiur8x
InChI InChI=1S/C17H25NO/c1-17(2,3)18-14-11-7-8-12-15(14)19-16(18)13-9-5-4-6-10-13/h4-6,9-10,14-16H,7-8,11-12H2,1-3H3/t14-,15-,16?/m1/s1
InChIKey QVBKGEMPVASAJP-YGFGXBMJSA-N
Mol Weight 259.39 g/mol
Molecular Formula C17H25NO
Exact Mass 259.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LdMxZfDqJyk
Name (3a,7a-trans)-octahydro-3-(t-butyl)-2-phenylbenzoxazole
Alternate Name(s) (3aR,7aR)-3-tert-butyl-2-phenyloctahydro-1,3-benzoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO
InChI InChI=1S/C17H25NO/c1-17(2,3)18-14-11-7-8-12-15(14)19-16(18)13-9-5-4-6-10-13/h4-6,9-10,14-16H,7-8,11-12H2,1-3H3/t14-,15-,16?/m1/s1
InChIKey QVBKGEMPVASAJP-YGFGXBMJSA-N
Molecular Weight 259.393 g/mol
SMILES C1(N([C@]2([C@](O1)(CCCC2)[H])[H])C(C)(C)C)c1ccccc1
SPLASH splash10-000l-7940000000-cb252ef65dd697a8a82b
Source of Spectrum AG-560-197-0
Wiley ID 1262963