CID 83434

13424-80-1

Structural Information

Molecular Formula
C9H18N2O2
SMILES
CN(C)C(=O)CCCC(=O)N(C)C
InChI
InChI=1S/C9H18N2O2/c1-10(2)8(12)6-5-7-9(13)11(3)4/h5-7H2,1-4H3
InChIKey
WFXSOGZBNQWNIV-UHFFFAOYSA-N
Compound name
N,N,N',N'-tetramethylpentanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

186.13683 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.144106 144.9
[M+Na]+ 209.126048 149.8
[M-H]- 185.129554 147.8
[M+NH4]+ 204.170653 165.4
[M+K]+ 225.099988 152.2
[M+H-H2O]+ 169.134090 138.7
[M+HCOO]- 231.135031 169.7
[M+CH3COO]- 245.150681 195.6
[M+Na-2H]- 207.111496 146.8
[M]+ 186.13628142 148.3
[M]- 186.13737858 148.3
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