CID 3053039

As-triazine, 5-cyclopropyl-3-methoxy-

Structural Information

Molecular Formula
C7H9N3O
SMILES
COC1=NC(=CN=N1)C2CC2
InChI
InChI=1S/C7H9N3O/c1-11-7-9-6(4-8-10-7)5-2-3-5/h4-5H,2-3H2,1H3
InChIKey
BGCPJNDJZNEUQX-UHFFFAOYSA-N
Compound name
5-cyclopropyl-3-methoxy-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

151.07455 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08183 140.9
[M+Na]+ 174.06377 152.0
[M-H]- 150.06727 144.5
[M+NH4]+ 169.10837 153.3
[M+K]+ 190.03771 148.9
[M+H-H2O]+ 134.07181 132.0
[M+HCOO]- 196.07275 162.8
[M+CH3COO]- 210.08840 178.8
[M+Na-2H]- 172.04922 148.7
[M]+ 151.07400 143.9
[M]- 151.07510 143.9
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