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Atropine-M/artifact -H2O ME     @
SpectraBase Compound ID ASdd1XJ7qDU
InChI InChI=1S/C10H10O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChIKey GQTXKEVAUZYHGE-UHFFFAOYSA-N
Mol Weight 162.19 g/mol
Molecular Formula C10H10O2
Exact Mass 162.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tTMafEC7ca
Name Atropic acid, methyl ester
Alternate Name(s) Methyl atropate 2-Phenyl-2-propenoic acid methyl ester 2-Phenylacrylic acid methyl ester Methyl 2-phenylacrylate Methyl 2-phenylprop-2-enoate
CAS Registry Number 1865-29-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2
InChI InChI=1S/C10H10O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChIKey GQTXKEVAUZYHGE-UHFFFAOYSA-N
Molecular Weight 162.188 g/mol
SMILES COC(C(=C)c1ccccc1)=O
SPLASH splash10-0udi-2900000000-5121268f1f9cfdd547e9
Source of Spectrum O-13-659-1
Wiley ID 1158537