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5-Bromo-4-[1,7,7-trimethyl-2-(2,2-dimethylpropyloxy)bicyclo[2.2.1]hept-2-yl]oxypent-1-yne
SpectraBase Compound ID Di3851rk184
InChI InChI=1S/C20H33BrO2/c1-8-9-16(13-21)23-20(22-14-17(2,3)4)12-15-10-11-19(20,7)18(15,5)6/h1,15-16H,9-14H2,2-7H3/t15-,16?,19-,20?/m0/s1
InChIKey JQLVOWYABMJAFZ-LRTSWPCHSA-N
Mol Weight 385.4 g/mol
Molecular Formula C20H33BrO2
Exact Mass 384.166393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLQBAKENjse
Name 5-Bromo-4-[1,7,7-trimethyl-2-(2,2-dimethylpropyloxy)bicyclo[2.2.1]hept-2-yl]oxypent-1-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H33BrO2
InChI InChI=1S/C20H33BrO2/c1-8-9-16(13-21)23-20(22-14-17(2,3)4)12-15-10-11-19(20,7)18(15,5)6/h1,15-16H,9-14H2,2-7H3/t15-,16?,19-,20?/m0/s1
InChIKey JQLVOWYABMJAFZ-LRTSWPCHSA-N
Molecular Weight 385.386 g/mol
SMILES C#CCC(CBr)OC1([C@]2(CC[C@@](C1)(C2(C)C)[H])C)OCC(C)(C)C
SPLASH splash10-00di-9600000000-1f0e8d802d38787a7bc0
Source of Spectrum SO-0-1001-2
Synonyms 2-{[1-(bromomethyl)-3-butynyl]oxy}-1,7,7-trimethyl-2-(neopentyloxy)bicyclo[2.2.1]heptane
Wiley ID 1544354