CID 506586

1-(3-bicyclo[2.2.1]hept-4-enyl)-2h-1,3,5-triazine-4,6-diamine

Structural Information

Molecular Formula
C10H15N5
SMILES
C1C=C2CC1CC2N3CN=C(N=C3N)N
InChI
InChI=1S/C10H15N5/c11-9-13-5-15(10(12)14-9)8-4-6-1-2-7(8)3-6/h2,6,8H,1,3-5H2,(H4,11,12,13,14)
InChIKey
BTCCXVKJCAOBLY-UHFFFAOYSA-N
Compound name
1-(2-bicyclo[2.2.1]hept-1(6)-enyl)-2H-1,3,5-triazine-4,6-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.13275 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.14003 143.8
[M+Na]+ 228.12197 151.8
[M-H]- 204.12547 145.7
[M+NH4]+ 223.16657 163.2
[M+K]+ 244.09591 148.2
[M+H-H2O]+ 188.13001 135.8
[M+HCOO]- 250.13095 163.5
[M+CH3COO]- 264.14660 155.6
[M+Na-2H]- 226.10742 146.6
[M]+ 205.13220 139.3
[M]- 205.13330 139.3
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.