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Acetic acid 3-cyclohex-1-enyl-1-methyl-prop-2-ynyl ester
SpectraBase Compound ID BG2kVonYL18
InChI InChI=1S/C12H16O2/c1-10(14-11(2)13)8-9-12-6-4-3-5-7-12/h6,10H,3-5,7H2,1-2H3
InChIKey HWUVWTVJCIZTMA-UHFFFAOYSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23Gu7Jmqwfx
Name Benzoic acid, 3-chloro-, methyl ester
Alternate Name(s) Acetic acid, 3-cyclohex-1-enyl-1-methylprop-2-ynyl ester 3-Chlorobenzoic acid methyl ester 3-(1-Cyclohexen-1-yl)-1-methyl-2-propynyl acetate 3-Cl-C6H4-COOCH3 4-(cyclohex-1-en-1-yl)but-3-yn-2-yl acetate Acetic acid 3-cyclohex-1-enyl-1-methyl-prop-2-ynyl ester Benzoic acid, m-chloro-, methyl ester m-Chlorobenzoic acid methyl ester 4-(cyclohexen-1-yl)but-3-yn-2-yl acetate Acetic acid 4-(1-cyclohexenyl)but-3-yn-2-yl ester Methyl 3-chloranylbenzoate Methyl 3-chlorobenzoate 4-(cyclohexen-1-yl)but-3-yn-2-yl ethanoate [3-(cyclohexen-1-yl)-1-methyl-prop-2-ynyl] acetate Methyl m-chlorobenzoate EINECS 220-814-1 HSDB 5465
CAS Registry Number 162518-99-2
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Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-10(14-11(2)13)8-9-12-6-4-3-5-7-12/h6,10H,3-5,7H2,1-2H3
InChIKey HWUVWTVJCIZTMA-UHFFFAOYSA-N
Molecular Weight 192.258 g/mol
SMILES C1C=C(CCC1)C#CC(OC(=O)C)C
SPLASH splash10-000f-6900000000-e4674fca1b82a82b9527
Wiley ID 1488988