CID 61914554

2-amino-5-(dimethylamino)-2-methylpentanoic acid dihydrochloride

Structural Information

Molecular Formula
C8H18N2O2
SMILES
CC(CCCN(C)C)(C(=O)O)N
InChI
InChI=1S/C8H18N2O2/c1-8(9,7(11)12)5-4-6-10(2)3/h4-6,9H2,1-3H3,(H,11,12)
InChIKey
BQADPYAWODDMFE-UHFFFAOYSA-N
Compound name
2-amino-5-(dimethylamino)-2-methylpentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

174.13683 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.14411 141.3
[M+Na]+ 197.12605 146.2
[M-H]- 173.12955 141.0
[M+NH4]+ 192.17065 160.7
[M+K]+ 213.09999 146.7
[M+H-H2O]+ 157.13409 136.2
[M+HCOO]- 219.13503 163.0
[M+CH3COO]- 233.15068 187.4
[M+Na-2H]- 195.11150 144.8
[M]+ 174.13628 141.0
[M]- 174.13738 141.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.