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Methyl (1S,3R,5R,6R)-6-bromo-3-(t-butyl)-6-(1-hydroxy-1-methylethyl-1-methyl-2-oxa-4-azabicyclo[3.1.0]hexane-4-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (1S,3R,5R,6R)-6-bromo-3-(t-butyl)-6-(1-hydroxy-1-methylethyl-1-methyl-2-oxa-4-azabicyclo[3.1.0]hexane-4-carboxylate
SpectraBase Compound ID KGEY1vEftmw
InChI InChI=1S/C14H24BrNO4/c1-11(2,3)9-16(10(17)19-7)8-13(6,20-9)14(8,15)12(4,5)18/h8-9,18H,1-7H3/t8-,9-,13+,14-/m1/s1
InChIKey QILSHRPLPSFZDL-NHPAQXRMSA-N
Mol Weight 350.25 g/mol
Molecular Formula C14H24BrNO4
Exact Mass 349.088871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBG3URdc7Mp
Name Methyl (1S,3R,5R,6R)-6-bromo-3-(t-butyl)-6-(1-hydroxy-1-methylethyl-1-methyl-2-oxa-4-azabicyclo[3.1.0]hexane-4-carboxylate
CAS Registry Number 116842-28-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24BrNO4
InChI InChI=1S/C14H24BrNO4/c1-11(2,3)9-16(10(17)19-7)8-13(6,20-9)14(8,15)12(4,5)18/h8-9,18H,1-7H3/t8-,9-,13+,14-/m1/s1
InChIKey QILSHRPLPSFZDL-NHPAQXRMSA-N
Molecular Weight 350.253 g/mol
SMILES OC([C@]1([C@@]2([C@]1(N(C(=O)OC)[C@](O2)(C(C)(C)C)[H])[H])C)Br)(C)C
SPLASH splash10-0006-9410000000-be8910ee90259b3db4e4
Source of Spectrum K-122-2384-14
Synonyms Methyl (1R,3R,5R,6R)-6-bromo-3-tert-butyl-6-(1-hydroxy-1-methylethyl)-1-methyl-2-oxa-4-azabicyclo[3.1.0]hexane-4-carboxylate
Wiley ID 1341246