
 (Z)-cinnamyl alcohol

 20 20  0  0  0  0  0  0  0  0999 V2000
   -1.5241   -0.0138    0.0569 C   0  0  0  0  0
   -0.8344    1.1947   -0.0054 C   0  0  0  0  0
    0.5614    1.2013   -0.0731 C   0  0  0  0  0
    1.2828   -0.0001   -0.0905 C   0  0  0  0  0
    0.5770   -1.2081   -0.0106 C   0  0  0  0  0
   -0.8190   -1.2150    0.0569 C   0  0  0  0  0
    2.7517    0.0555   -0.1301 C   0  0  0  0  0
    3.5307   -0.8626   -0.7248 C   0  0  0  0  0
    5.0207   -0.7913   -0.7678 C   0  0  0  0  0
    5.5411   -1.9437   -0.1253 O   0  0  0  0  0
   -2.6101   -0.0199    0.1099 H   0  0  0  0  0
   -1.3820    2.1336   -0.0007 H   0  0  0  0  0
    1.0790    2.1567   -0.1216 H   0  0  0  0  0
    1.1037   -2.1587    0.0103 H   0  0  0  0  0
   -1.3536   -2.1596    0.1143 H   0  0  0  0  0
    3.2027    0.9217    0.3496 H   0  0  0  0  0
    3.0930   -1.7161   -1.2368 H   0  0  0  0  0
    5.4158    0.0975   -0.2658 H   0  0  0  0  0
    5.3696   -0.7849   -1.8046 H   0  0  0  0  0
    5.1389   -1.9762    0.7597 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 11  1  0  0  0
  2  3  1  0  0  0
  2 12  1  0  0  0
  3  4  2  0  0  0
  3 13  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
  5  6  2  0  0  0
  5 14  1  0  0  0
  6 15  1  0  0  0
  7  8  2  0  0  0
  7 16  1  0  0  0
  8  9  1  0  0  0
  8 17  1  0  0  0
  9 10  1  0  0  0
  9 18  1  0  0  0
  9 19  1  0  0  0
 10 20  1  0  0  0
M  END

>  <Chemical Name>
(Z)-cinnamyl alcohol

>  <PubChem CID>
5280511

>  <Formula>
C9H10O

>  <Molecular Weight>
134.178000

>  <IUPAC Name>
(Z)-3-phenylprop-2-en-1-ol

>  <XlogP>
1.900

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C1=CC=C(C=C1)C=CCO

>  <Isomeric SMILES>
C1=CC=C(C=C1)/C=C\CO

>  <InChI Std. ID>
InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4-

>  <InChI Key>
OOCCDEMITAIZTP-DAXSKMNVSA-N

