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Reference substances

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IUPAC name:
octadec-9-enoic acid

Inventory

EC number:
204-007-1
EC name:
Oleic acid
CAS number:
112-80-1
CAS number:
112-80-1
Synonyms
Names:
9-Octadecenoic acid (9Z)-
9-Octadecenoic acid (Z)-
Oleic acid (9Z)-Octadec-9-enoic acid 18:1 cis-9
Identifier:
IUPAC name
(9E)-octadec-9-enoic acid
Identifier:
IUPAC name
(9Z)-Octadec-9-enoic acid
Identifier:
IUPAC name
(9Z)-octadec-9-enoic acid
Identifier:
IUPAC name
oleic acid
Identifier:
other: InChl
1/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-/f/h19H
Identifier:
other: SMILES notation
CCCCCCCC/C=C/CCCCCCCC(O)=O
Identifier:
other: SMILES notation
CCCCCCCCC=CCCCCCCCC(=O)O
Identifier:
other: SMILES notation
CCCCCCCC\C=C/CCCCCCCC(O)=O
Identifier:
other: SMILES notation
CCCCCCCC\C=C\CCCCCCCC(O)=O
Identifier:
other: InChl
InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h6-7H,2-5,8-14H2,1H3,(H,16,17)/b7-6-
Identifier:
other: InChl
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+
Identifier:
other: InChl
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-
Identifier:
other: SMILES notation
O=C(O)CCCCCCC\C=C\CCCCCCCC
Identifier:
other: SMILES notation
OC(CCCCCCC/C=C\CCCCCCCC)=O

Molecular and structural information

Molecular formula:
C18H34O2
Molecular weight:
282.461
SMILES notation:
CCCCCCCC\C=C/CCCCCCCC(=O)O
InChl:
InChI=1/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)
Structural formula:
Chemical structure

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