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Heptanoic acid, 7-bromo-, (3-methyl-3-oxetanyl)methyl ester
SpectraBase Compound ID 8366ePiU2VR
InChI InChI=1S/C12H21BrO3/c1-12(8-15-9-12)10-16-11(14)6-4-2-3-5-7-13/h2-10H2,1H3
InChIKey LFAWVXGVKKYTFX-UHFFFAOYSA-N
Mol Weight 293.2 g/mol
Molecular Formula C12H21BrO3
Exact Mass 292.067408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3wubkEhu92q
Name Heptanoic acid, 7-bromo-, (3-methyl-3-oxetanyl)methyl ester
CAS Registry Number 129884-26-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21BrO3
InChI InChI=1S/C12H21BrO3/c1-12(8-15-9-12)10-16-11(14)6-4-2-3-5-7-13/h2-10H2,1H3
InChIKey LFAWVXGVKKYTFX-UHFFFAOYSA-N
Molecular Weight 293.201 g/mol
SMILES C1(COC(=O)CCCCCCBr)(COC1)C
SPLASH splash10-0006-5900000000-1521bf918d90b13abcf1
Source of Spectrum KC-1990-378-0
Synonyms (3-methyl-3-oxetanyl)methyl 7-bromoheptanoate
Wiley ID 1295002