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mandelonitrile

Properties

Image

Occurences in reactions

MNX_ID

MNXM1106178

	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

formula

C₈H₇NO

charge

mass

133.05276

reference

InChIKey

NNICRUQPODTGRU-UHFFFAOYSA-N

InChI

InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H

SMILES

N#CC(O)c1ccccc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16910 chebi:16910	mandelonitrile Benzaldehyde cyanohydrin Mandelonitrile alpha-hydroxybenzeneacetonitrile hydroxy(phenyl)acetonitrile mandelic acid nitrile phenylglycolonitrile
hmdb:HMDB0034666	(+/-)-2-Hydroxy-2-phenylacetonitrile 2-hydroxy-2-phenylacetonitrile Benzaldehyde cyanohydrin Mandelate nitrile Mandelic acid nitrile Mandelonitrile, (+-)-isomer Phenylglycolonitrile a-Hydroxybenzeneacetonitrile alpha-Hydroxybenzeneacetonitrile alpha-hydroxybenzeneacetonitrile mandelonitrile
seed.compound:cpd27435 seedM:cpd27435	MANDELONITRILE
sabiork.compound:5140 sabiorkM:5140	Mandelonitrile Benzaldehyde cyanohydrin
metacyc.compound:MANDELONITRILE metacycM:MANDELONITRILE	mandelonitrile
hmdb:HMDB34666 chebi:14573 chebi:25151 chebi:6680 seedM:M_cpd27435	secondary/obsolete/fantasy identifier