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Methyl 3-bromo-1-adamantaneacetate
SpectraBase Compound ID 3u1aEObtUlf
InChI InChI=1S/C13H19BrO2/c1-16-11(15)7-12-3-9-2-10(4-12)6-13(14,5-9)8-12/h9-10H,2-8H2,1H3/t9-,10+,12-,13-
InChIKey FFYYJJRMGKTOQM-ORGJANLZSA-N
Mol Weight 287.2 g/mol
Molecular Formula C13H19BrO2
Exact Mass 286.056843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmRxYftN1TH
Name Methyl (3-bromo-1-adamantyl)acetate
Alternate Name(s) Methyl 3-bromo-1-adamantaneacetate Tricyclo[3.3.1.1(3,7)-]decane-1-carboxylic acid, 3-bromo-5-methyl-, methyl ester Methyl 2-(3-bromo-1-adamantyl)acetate Methyl 2-(3-bromanyl-1-adamantyl)ethanoate
CAS Registry Number 14575-01-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19BrO2
InChI InChI=1S/C13H19BrO2/c1-16-11(15)7-12-3-9-2-10(4-12)6-13(14,5-9)8-12/h9-10H,2-8H2,1H3/t9-,10+,12-,13-
InChIKey FFYYJJRMGKTOQM-ORGJANLZSA-N
Molecular Weight 287.197 g/mol
SMILES C(=O)(OC)C[C@]12C[C@]3(Br)C[C@@](C[C@](C2)(C3)[H])(C1)[H]
SPLASH splash10-0a4i-8790000000-3adbf6be45eb071d383b
Source of Spectrum NP-9-2638-0
Wiley ID 1107983