CID 42933681

(1-amino-4-methylpentan-2-yl)diethylamine

Structural Information

Molecular Formula
C10H24N2
SMILES
CCN(CC)C(CC(C)C)CN
InChI
InChI=1S/C10H24N2/c1-5-12(6-2)10(8-11)7-9(3)4/h9-10H,5-8,11H2,1-4H3
InChIKey
VFIZLVLYYTWDDN-UHFFFAOYSA-N
Compound name
2-N,2-N-diethyl-4-methylpentane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.19395 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.201226 147.4
[M+Na]+ 195.183168 151.0
[M-H]- 171.186674 148.0
[M+NH4]+ 190.227773 167.7
[M+K]+ 211.157108 151.6
[M+H-H2O]+ 155.191210 141.4
[M+HCOO]- 217.192151 169.7
[M+CH3COO]- 231.207801 193.6
[M+Na-2H]- 193.168616 148.2
[M]+ 172.19340142 147.5
[M]- 172.19449858 147.5
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

No patent data available for this compound.