For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(hydroxymethyl)-3,4,5-tris(oxidanyl)piperidine-2-carbonitrile
SpectraBase Compound ID JT10duTQ560
InChI InChI=1S/C7H12N2O4/c8-2-7(3-10)6(13)5(12)4(11)1-9-7/h4-6,9-13H,1,3H2
InChIKey CMFNIKGKGLDYQZ-UHFFFAOYSA-N
Mol Weight 188.18 g/mol
Molecular Formula C7H12N2O4
Exact Mass 188.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Ijugi5aYM5
Name 2-(hydroxymethyl)-3,4,5-tris(oxidanyl)piperidine-2-carbonitrile
Alternate Name(s) 3,4,5-trihydroxy-2-(hydroxymethyl)-2-piperidinecarbonitrile 3,4,5-trihydroxy-2-(hydroxymethyl)piperidine-2-carbonitrile 3,4,5-trihydroxy-2-methylol-pipecolinonitrile 5-Cyano-desoxinojirimycin
CAS Registry Number 91840-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N2O4
InChI InChI=1S/C7H12N2O4/c8-2-7(3-10)6(13)5(12)4(11)1-9-7/h4-6,9-13H,1,3H2
InChIKey CMFNIKGKGLDYQZ-UHFFFAOYSA-N
Molecular Weight 188.183 g/mol
SMILES OC1C(C(NCC1O)(C#N)CO)O
SPLASH splash10-0k96-9300000000-70e2fd63750fe838be3d
Source of Spectrum O-19-178-3
Wiley ID 1184192