CID 14251537

2-methylbutane-2,3-diamine dihydrochloride

Structural Information

Molecular Formula
C5H14N2
SMILES
CC(C(C)(C)N)N
InChI
InChI=1S/C5H14N2/c1-4(6)5(2,3)7/h4H,6-7H2,1-3H3
InChIKey
MIKNSPXOIZYKIT-UHFFFAOYSA-N
Compound name
2-methylbutane-2,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3244
Patents

102.1157 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.12298 123.4
[M+Na]+ 125.10492 129.5
[M-H]- 101.10842 123.1
[M+NH4]+ 120.14952 145.6
[M+K]+ 141.07886 129.6
[M+H-H2O]+ 85.112960 119.1
[M+HCOO]- 147.11390 145.6
[M+CH3COO]- 161.12955 173.6
[M+Na-2H]- 123.09037 128.5
[M]+ 102.11515 119.4
[M]- 102.11625 119.4
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

patents stripe