CID 6483877

1-(1,3-dimethyl-1h-pyrazol-4-yl)ethanamine

Structural Information

Molecular Formula
C7H13N3
SMILES
CC1=NN(C=C1C(C)N)C
InChI
InChI=1S/C7H13N3/c1-5(8)7-4-10(3)9-6(7)2/h4-5H,8H2,1-3H3
InChIKey
ZHCIXQMRFVTGGF-UHFFFAOYSA-N
Compound name
1-(1,3-dimethylpyrazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

139.11095 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.11823 129.7
[M+Na]+ 162.10017 140.4
[M+NH4]+ 157.14477 137.5
[M+K]+ 178.07411 137.4
[M-H]- 138.10367 130.5
[M+Na-2H]- 160.08562 134.6
[M]+ 139.11040 131.2
[M]- 139.11150 131.2
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