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trans-(2S,3aR,4R,7aS)-2-(Phenylmethyl)-3-(2,2-dimethylethyl)-7,8,8-trimethyldecahydro-4a,7-methano-1H-1,3,2-oxazaphorinane-2-oxide

View entire compound with spectra: 1 MS (GC)

trans-(2S,3aR,4R,7aS)-2-(Phenylmethyl)-3-(2,2-dimethylethyl)-7,8,8-trimethyldecahydro-4a,7-methano-1H-1,3,2-oxazaphorinane-2-oxide
SpectraBase Compound ID F1rB4MeOJuG
InChI InChI=1S/C21H32NO2P/c1-15(2)13-22-18-17-11-12-21(5,20(17,3)4)19(18)24-25(22,23)14-16-9-7-6-8-10-16/h6-10,15,17-19H,11-14H2,1-5H3/t17-,18-,19+,21+,25+/m0/s1
InChIKey GYECTATZDPHDIY-YTOCAZORSA-N
Mol Weight 361.5 g/mol
Molecular Formula C21H32NO2P
Exact Mass 361.217066 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeNWDVN1MAr
Name trans-(2S,3aR,4R,7aS)-2-(Phenylmethyl)-3-(2,2-dimethylethyl)-7,8,8-trimethyldecahydro-4a,7-methano-1H-1,3,2-oxazaphorinane-2-oxide
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Formula C21H32NO2P
InChI InChI=1S/C21H32NO2P/c1-15(2)13-22-18-17-11-12-21(5,20(17,3)4)19(18)24-25(22,23)14-16-9-7-6-8-10-16/h6-10,15,17-19H,11-14H2,1-5H3/t17-,18-,19+,21+,25+/m0/s1
InChIKey GYECTATZDPHDIY-YTOCAZORSA-N
Molecular Weight 361.466 g/mol
SMILES [C@]12(N([P@](O[C@]1([C@]1(CC[C@@]2(C1(C)C)[H])C)[H])(Cc1ccccc1)=O)CC(C)C)[H]
SPLASH splash10-052g-9117000000-3477f87b6777ec958677
Source of Spectrum F-48-2203-6
Synonyms (2S,6R,7R)-4-benzyl-5-isobutyl-1,10,10-trimethyl-3-oxa-5-aza-4-phosphatricyclo[5.2.1.0(2,6)]decane 4-oxide
Wiley ID 1349052