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2-Butenedioic acid, 2-(bromomethyl)-, 1-methyl ester, (Z)-
SpectraBase Compound ID 4ne0IAUCeUO
InChI InChI=1S/C6H7BrO4/c1-11-6(10)4(3-7)2-5(8)9/h2H,3H2,1H3,(H,8,9)/b4-2+
InChIKey HMKASKBCGMCCEW-DUXPYHPUSA-N
Mol Weight 223.02 g/mol
Molecular Formula C6H7BrO4
Exact Mass 221.952772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2JrQBceEf4
Name 2-Butenedioic acid, 2-(bromomethyl)-, 1-methyl ester, (Z)-
Alternate Name(s) (2Z)-3-(bromomethyl)-4-methoxy-4-oxo-2-butenoic acid (Z)-3-Methoxycarbonyl-4-bromobut-2-enoic acid (Z)-3-(bromomethyl)-4-methoxy-4-oxo-2-butenoic acid (Z)-3-(bromomethyl)-4-methoxy-4-oxobut-2-enoic acid (Z)-3-(bromomethyl)-4-methoxy-4-oxo-but-2-enoic acid (Z)-3-(bromomethyl)-4-methoxy-4-oxidanylidene-but-2-enoic acid
CAS Registry Number 69804-86-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7BrO4
InChI InChI=1S/C6H7BrO4/c1-11-6(10)4(3-7)2-5(8)9/h2H,3H2,1H3,(H,8,9)/b4-2+
InChIKey HMKASKBCGMCCEW-DUXPYHPUSA-N
Molecular Weight 223.022 g/mol
SMILES OC(\C=C\(C(=O)OC)CBr)=O
SPLASH splash10-06rl-9730000000-eb47edd94df51ab04d5e
Source of Spectrum KC-1978-1492-0
Wiley ID 1221643