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3alpha-Tigloyloxytropane N-oxide

Properties

Image

Occurences in reactions

MNX_ID

MNXM117645

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

formula

C₁₃H₂₁NO₃

charge

mass

239.15214

reference

InChIKey

VNARLHBYSZUQEN-RUDMXATFSA-N

InChI

InChI=1S/C13H21NO3/c1-4-9(2)13(15)17-12-7-10-5-6-11(8-12)14(10,3)16/h4,10-12H,5-8H2,1-3H3/b9-4+

SMILES

C/C=C(\C)C(=O)OC1CC2CCC(C1)[N+]2(C)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:173730 chebi:173730	3alpha-Tigloyloxytropane N-oxide (8-methyl-8-oxido-8-azoniabicyclo[3.2.1]octan-3-yl) (E)-2-methylbut-2-enoate
hmdb:HMDB0033454	3alpha-Tigloyloxytropane N-oxide 3a-Tigloyloxytropane N-oxide 3alpha-tigloyloxytropane N-oxide 8-Methyl-8-oxo-8lambda⁵-azabicyclo[3.2.1]octan-3-yl (2E)-2-methylbut-2-enoic acid 8-methyl-8-oxo-8lambda⁵-azabicyclo[3.2.1]octan-3-yl (2E)-2-methylbut-2-enoate
hmdb:HMDB33454	secondary/obsolete/fantasy identifier