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ANGELIC-ACID-METHYLESTER
SpectraBase Compound ID 2PsymWw2tnD
InChI InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4-
InChIKey YYJWBYNQJLBIGS-PLNGDYQASA-N
Mol Weight 114.14 g/mol
Molecular Formula C6H10O2
Exact Mass 114.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mvvPLB2j8t
Name 2-Butenoic acid, 2-methyl-, methyl ester, (Z)-
Alternate Name(s) 2-Butenoic acid, 2-methyl-, methyl ester (Z)-2-methyl-2-butenoic acid methyl ester Angelic acid, methyl ester Methyl (2E)-2-methyl-2-butenoate (Z)-2-methylbut-2-enoic acid methyl ester Crotonic acid, 2-methyl-, methyl ester, (Z)- Methyl (Z)-2-methylbut-2-enoate Methyl 2-methyl-2-butenoate Methyl 2-methylcrotonate Methyl 2-methylisocrotonate Methyl angelate Methyl cis-2-methylcrotonate EINECS 227-718-9 EINECS 255-518-1
CAS Registry Number 5953-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O2
InChI InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4-
InChIKey YYJWBYNQJLBIGS-PLNGDYQASA-N
Molecular Weight 114.144 g/mol
SMILES C\C=C\(C)C(=O)OC
SPLASH splash10-0bu0-9300000000-efed9cf5e5ff1ece42d9
Source of Spectrum O-11-832-1
Wiley ID 1124252