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4-Anti-Bromo-1-isopropyl-2-oxaadamantane
SpectraBase Compound ID 1CfkjBR74Dt
InChI InChI=1S/C12H19BrO/c1-7(2)12-5-8-3-9(6-12)11(13)10(4-8)14-12/h7-11H,3-6H2,1-2H3/t8?,9-,10-,11+,12+/m1/s1
InChIKey RWJBIFYNFAERQJ-CWZNHRJFSA-N
Mol Weight 259.19 g/mol
Molecular Formula C12H19BrO
Exact Mass 258.061928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Itipr3jrsdL
Name 4-Anti-Bromo-1-isopropyl-2-oxaadamantane
Alternate Name(s) 4-Bromo-1-isopropyl-2-oxatricyclo[3.3.1.1(3,7)]decane
CAS Registry Number 78726-37-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19BrO
InChI InChI=1S/C12H19BrO/c1-7(2)12-5-8-3-9(6-12)11(13)10(4-8)14-12/h7-11H,3-6H2,1-2H3/t8?,9-,10-,11+,12+/m1/s1
InChIKey RWJBIFYNFAERQJ-CWZNHRJFSA-N
Molecular Weight 259.187 g/mol
SMILES [C@]12(O[C@@]3(CC(C2)C[C@](C1)([C@@]3(Br)[H])[H])[H])C(C)C
SPLASH splash10-006x-8920000000-71c7713d35aca4bfe40d
Source of Spectrum J-46-5336-0
Wiley ID 1261434