CID 252601

Nonanediamide

Structural Information

Molecular Formula
C9H18N2O2
SMILES
C(CCCC(=O)N)CCCC(=O)N
InChI
InChI=1S/C9H18N2O2/c10-8(12)6-4-2-1-3-5-7-9(11)13/h1-7H2,(H2,10,12)(H2,11,13)
InChIKey
FJXWKBZRTWEWBJ-UHFFFAOYSA-N
Compound name
nonanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3914
Patents

186.13683 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.14411 145.4
[M+Na]+ 209.12605 149.7
[M-H]- 185.12955 144.0
[M+NH4]+ 204.17065 163.8
[M+K]+ 225.09999 148.5
[M+H-H2O]+ 169.13409 139.3
[M+HCOO]- 231.13503 167.8
[M+CH3COO]- 245.15068 188.6
[M+Na-2H]- 207.11150 146.5
[M]+ 186.13628 144.2
[M]- 186.13738 144.2
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