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7-Bromo-5-heptynoic acid methyl ester
SpectraBase Compound ID 3jFUPXH0R1w
InChI InChI=1S/C8H11BrO2/c1-11-8(10)6-4-2-3-5-7-9/h2,4,6-7H2,1H3
InChIKey ORMJOYKCTLOKIS-UHFFFAOYSA-N
Mol Weight 219.08 g/mol
Molecular Formula C8H11BrO2
Exact Mass 217.994243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQiVdePDTfw
Name 7-Bromo-5-heptynoic acid methyl ester
CAS Registry Number 41349-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H11BrO2
InChI InChI=1S/C8H11BrO2/c1-11-8(10)6-4-2-3-5-7-9/h2,4,6-7H2,1H3
InChIKey ORMJOYKCTLOKIS-UHFFFAOYSA-N
Molecular Weight 219.078 g/mol
SMILES C(#CCCCC(=O)OC)CBr
SPLASH splash10-002k-2900000000-6141bd05adf698f9f869
Source of Spectrum B-40-279-9
Synonyms 7-Bromohept-5-ynoic acid methyl ester Methyl 7-bromanylhept-5-ynoate Methyl 7-bromo-5-heptynoate Methyl 7-bromohept-5-ynoate
Wiley ID 1217012