CID 43272632

(2-aminoethyl)(butan-2-yl)methylamine

Structural Information

Molecular Formula
C7H18N2
SMILES
CCC(C)N(C)CCN
InChI
InChI=1S/C7H18N2/c1-4-7(2)9(3)6-5-8/h7H,4-6,8H2,1-3H3
InChIKey
BKUIZZSXNHURBW-UHFFFAOYSA-N
Compound name
N'-butan-2-yl-N'-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

130.147 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.15428 132.9
[M+Na]+ 153.13622 137.9
[M-H]- 129.13972 133.9
[M+NH4]+ 148.18082 154.8
[M+K]+ 169.11016 138.9
[M+H-H2O]+ 113.14426 127.3
[M+HCOO]- 175.14520 157.2
[M+CH3COO]- 189.16085 183.6
[M+Na-2H]- 151.12167 136.6
[M]+ 130.14645 132.4
[M]- 130.14755 132.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe