CID 284646

Pimelic acid dihydrazide

Structural Information

Molecular Formula
C7H16N4O2
SMILES
C(CCC(=O)NN)CCC(=O)NN
InChI
InChI=1S/C7H16N4O2/c8-10-6(12)4-2-1-3-5-7(13)11-9/h1-5,8-9H2,(H,10,12)(H,11,13)
InChIKey
OXAGUPFRAIIDLT-UHFFFAOYSA-N
Compound name
heptanedihydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1444
Patents

188.12732 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.134596 142.3
[M+Na]+ 211.116538 145.8
[M-H]- 187.120044 141.3
[M+NH4]+ 206.161143 159.9
[M+K]+ 227.090478 145.4
[M+H-H2O]+ 171.124580 135.3
[M+HCOO]- 233.125521 167.3
[M+CH3COO]- 247.141171 191.9
[M+Na-2H]- 209.101986 145.0
[M]+ 188.12677142 138.5
[M]- 188.12786858 138.5
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