Ketcher 11131913262D 1   1.00000     0.00000     0

  8  7  0     0  0            999 V2000
   10.8346   -5.3742    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9685   -4.8742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1025   -5.3742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2365   -4.8742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3705   -5.3742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2365   -3.8742    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1025   -6.3742    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5044   -4.8742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  4  6  1  4     0  0
  3  7  1  4     0  0
  5  8  1  0     0  0
M  END
> <ID>
CHEBI:145349

> <NAME>
2-penten-1-ol

> <DEFINITION>
A primary allylic alcohol that is 2-pentene in which a hydrogen at position 1 has been replaced by a hydroxy group.

> <STAR>
3

> <SYNONYM>
2-pentenol

> <IUPAC_NAME>
pent-2-en-1-ol

> <FORMULA>
C5H10O

> <MASS>
86.134

> <MONOISOTOPIC_MASS>
86.07316

> <CHARGE>
0

> <SMILES>
OCC(=C(CC)[H])[H]

> <INCHI>
InChI=1S/C5H10O/c1-2-3-4-5-6/h3-4,6H,2,5H2,1H3

> <INCHIKEY>
BTSIZIIPFNVMHF-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
20273-24-9

> <CHEMIDPLUS>
20273-24-9

> <NIST_CHEMISTRY_WEBBOOK>
20273-24-9

$$$$