Debug Info

object
{26}
_id
:
4MDQVCh5qjb
compoundID
:
4MDQVCh5qjb
ambiguous
:
false
names
[0]
name
:
(4R)-ISOPROPYL-9-AMINO-3,6-DIAZANONANE-TRIS-(TRIFLUOROACETATIC-ACID)-SALT
ambiguousSiblings
[0]
hasStructure
:
true
recordSources
[1]
properties
{7}
spectrumSourcesMap
{1}
spectrumSourcesMapSuggestedOrder
[1]
parentCompound
{1}
otherEnantiomer1Compound
{1}
racemateCompound
{1}
saltCompounds
[0]
isotopicCompounds
[0]
stereoisomerCompounds
[0]
stereoisomerSaltCompounds
[0]
similarCompounds
[10]
vendors
[0]
articles
[1]
lastUpdated
:
1735071411015
isDeprecated
:
false
productInfo
[1]
spectrumSourcesMapCountOriginal
:
1
spectrumSourcesMapCountFiltered
:
1

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(4R)-ISOPROPYL-9-AMINO-3,6-DIAZANONANE-TRIS-(TRIFLUOROACETATIC-ACID)-SALT
SpectraBase Compound ID 4MDQVCh5qjb
InChI InChI=1S/C10H25N3.3C2HF3O2/c1-4-13-10(9(2)3)8-12-7-5-6-11;3*3-2(4,5)1(6)7/h9-10,12-13H,4-8,11H2,1-3H3;3*(H,6,7)/t10-;;;/m1.../s1
InChIKey UBYNVWCFRVAKSI-FYBBWCNBSA-N
Mol Weight 529.401 g/mol
Molecular Formula C16H28F9N3O6
Exact Mass 529.183439 g/mol
Parent InChIKey PCTDDVWLRDWTPR-SNVBAGLBSA-N
Enantiomer InChIKey UBYNVWCFRVAKSI-KAFJHEIMSA-N
Racemate InChIKey UBYNVWCFRVAKSI-UHFFFAOYSA-N
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