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2-Propenoic acid, 3-chloro-3-[4-(phenylmethoxy)phenyl]-
SpectraBase Compound ID 77mELd5t2Aw
InChI InChI=1S/C16H13ClO3/c17-15(10-16(18)19)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,19)/b15-10-
InChIKey IVMQOKDEMPNACJ-GDNBJRDFSA-N
Mol Weight 288.73 g/mol
Molecular Formula C16H13ClO3
Exact Mass 288.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45g27WZ8o6y
Name 2-Propenoic acid, 3-chloro-3-[4-(phenylmethoxy)phenyl]-
Alternate Name(s) (2Z)-3-[4-(benzyloxy)phenyl]-3-chloro-2-propenoic acid Chlorocinnamic acid
CAS Registry Number 73583-47-8
Comments Less than 3 mono-isotopic peaks
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Formula C16H13ClO3
InChI InChI=1S/C16H13ClO3/c17-15(10-16(18)19)13-6-8-14(9-7-13)20-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,18,19)/b15-10-
InChIKey IVMQOKDEMPNACJ-GDNBJRDFSA-N
Molecular Weight 288.730 g/mol
SMILES OC(\C=C\(c1ccc(OCc2ccccc2)cc1)Cl)=O
SPLASH splash10-0a4r-0090000000-7d4a680814f4138f6684
Source of Spectrum F-35-1670-0
Wiley ID 1291633