CID 79006287

1379341-87-3

Structural Information

Molecular Formula
C9H13N5
SMILES
CN1C=CN=C1C(C2=NC=CN2C)N
InChI
InChI=1S/C9H13N5/c1-13-5-3-11-8(13)7(10)9-12-4-6-14(9)2/h3-7H,10H2,1-2H3
InChIKey
CSHAWDNWYAETDR-UHFFFAOYSA-N
Compound name
bis(1-methylimidazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.1171 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.124376 140.3
[M+Na]+ 214.106318 150.6
[M-H]- 190.109824 142.9
[M+NH4]+ 209.150923 157.8
[M+K]+ 230.080258 148.0
[M+H-H2O]+ 174.114360 131.2
[M+HCOO]- 236.115301 163.5
[M+CH3COO]- 250.130951 153.5
[M+Na-2H]- 212.091766 143.5
[M]+ 191.11655142 141.3
[M]- 191.11764858 141.3
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

No patent data available for this compound.