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2-Oxa-7-azatricyclo[4.4.0.0(3,8)]decane, 5-bromo-7-methyl-, stereoisomer
SpectraBase Compound ID 8DVNGZ2GMDD
InChI InChI=1S/C9H14BrNO/c1-11-6-2-3-7-9(11)5(10)4-8(6)12-7/h5-9H,2-4H2,1H3/t5?,6-,7-,8-,9-/m0/s1
InChIKey MQWCCEVFJFVIHM-UFHRUUPSSA-N
Mol Weight 232.12 g/mol
Molecular Formula C9H14BrNO
Exact Mass 231.025877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3ckPylUDKq
Name 2-Oxa-7-azatricyclo[4.4.0.0(3,8)]decane, 5-bromo-7-methyl-, stereoisomer
CAS Registry Number 63827-24-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14BrNO
InChI InChI=1S/C9H14BrNO/c1-11-6-2-3-7-9(11)5(10)4-8(6)12-7/h5-9H,2-4H2,1H3/t5?,6-,7-,8-,9-/m0/s1
InChIKey MQWCCEVFJFVIHM-UFHRUUPSSA-N
Molecular Weight 232.121 g/mol
SMILES [C@@]12(N([C@@]3([C@@](O[C@]2(CC3)[H])(CC1Br)[H])[H])C)[H]
SPLASH splash10-0f6x-9400000000-36c3786c9ae079f0f06b
Source of Spectrum H-60-1440-0
Synonyms 5-Bromo-7-methyl-2-oxa-7-azatricyclo[4.4.0.0(3,8)]decane N(2)-methyl-10*n(2)-bromo-2-aza-7-oxa-twistane
Wiley ID 1232506