CID 28808663

2703774-17-6

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C2=C(CCCC2)C(=N1)CN
InChI
InChI=1S/C9H15N3/c1-12-9-5-3-2-4-7(9)8(6-10)11-12/h2-6,10H2,1H3
InChIKey
XNGHXSWRWARUCX-UHFFFAOYSA-N
Compound name
(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.13388 135.9
[M+Na]+ 188.11582 146.7
[M+NH4]+ 183.16042 144.7
[M+K]+ 204.08976 142.3
[M-H]- 164.11932 137.6
[M+Na-2H]- 186.10127 140.3
[M]+ 165.12605 137.7
[M]- 165.12715 137.7
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

No patent data available for this compound.