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1-Methylheptyl 6-bromohexanoate
SpectraBase Compound ID EFT3mAKS5R2
InChI InChI=1S/C14H27BrO2/c1-3-4-5-7-10-13(2)17-14(16)11-8-6-9-12-15/h13H,3-12H2,1-2H3
InChIKey NZXOUVBCQKXWLD-UHFFFAOYSA-N
Mol Weight 307.27 g/mol
Molecular Formula C14H27BrO2
Exact Mass 306.119443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZwT9j9EaIg
Name 1-Methylheptyl 6-bromohexanoate
Alternate Name(s) 6-Bromohexanoic acid, 2-octyl ester 6-Bromohexanoic acid octan-2-yl ester Octan-2-yl 6-bromohexanoate Octan-2-yl 6-bromanylhexanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H27BrO2
InChI InChI=1S/C14H27BrO2/c1-3-4-5-7-10-13(2)17-14(16)11-8-6-9-12-15/h13H,3-12H2,1-2H3
InChIKey NZXOUVBCQKXWLD-UHFFFAOYSA-N
Molecular Weight 307.272 g/mol
SMILES CC(OC(CCCCCBr)=O)CCCCCC
SPLASH splash10-004i-9700000000-92fa8983aadb487af4b3
Source of Spectrum NP-10-4258-0
Wiley ID 1108881