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(3aS,5R,7R,7aR)-6,6,7a-Trimethylhexahydro-5,7-methanobenzo[d]oxazol-2(3H)-one
SpectraBase Compound ID 3X3mWMtYdpb
InChI InChI=1S/C11H17NO2/c1-10(2)6-4-7(10)11(3)8(5-6)12-9(13)14-11/h6-8H,4-5H2,1-3H3,(H,12,13)/t6-,7-,8+,11-/m1/s1
InChIKey SHMXEVYTKPIIMH-HGIWHZBTSA-N
Mol Weight 195.26 g/mol
Molecular Formula C11H17NO2
Exact Mass 195.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBL9yZbB5mj
Name (3aS,5R,7R,7aR)-6,6,7a-Trimethylhexahydro-5,7-methanobenzo[d]oxazol-2(3H)-one
Appearance White solid
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Exact Mass 195.125928789 u
Formula C11H17NO2
InChI InChI=1S/C11H17NO2/c1-10(2)6-4-7(10)11(3)8(5-6)12-9(13)14-11/h6-8H,4-5H2,1-3H3,(H,12,13)/t6-,7-,8+,11-/m1/s1
InChIKey SHMXEVYTKPIIMH-HGIWHZBTSA-N
Instrument Name MAT 95XP or HP 5973N MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.201600698
Molecular Weight 195.262 g/mol
Quality 166
Reported Formula C11H17NO2
SMILES N1C(O[C@]2([C@@]1(C[C@@]1(C([C@]2(C1)[H])(C)C)[H])[H])C)=O
SPLASH splash10-000t-9400000000-e0787a242470c734084e
Source of Spectrum ACI-55-SM7-7g (DOI: 10.1002/anie.201600698)
Wiley ID 1904446