CID 68808057

1788732-90-0

Structural Information

Molecular Formula
C7H14N4
SMILES
CC1=NN(C(=C1)NCCN)C
InChI
InChI=1S/C7H14N4/c1-6-5-7(9-4-3-8)11(2)10-6/h5,9H,3-4,8H2,1-2H3
InChIKey
CEFUSQUILPCBQX-UHFFFAOYSA-N
Compound name
N'-(2,5-dimethylpyrazol-3-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

154.12184 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.12912 133.1
[M+Na]+ 177.11106 141.5
[M-H]- 153.11456 134.2
[M+NH4]+ 172.15566 153.0
[M+K]+ 193.08500 139.6
[M+H-H2O]+ 137.11910 125.8
[M+HCOO]- 199.12004 157.9
[M+CH3COO]- 213.13569 182.1
[M+Na-2H]- 175.09651 138.3
[M]+ 154.12129 132.3
[M]- 154.12239 132.3
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