CID 415170

Nsc67476

Structural Information

Molecular Formula
C7H14N4
SMILES
C1CCC(=NN=C(N)N)CC1
InChI
InChI=1S/C7H14N4/c8-7(9)11-10-6-4-2-1-3-5-6/h1-5H2,(H4,8,9,11)
InChIKey
YTTZYOIOUMXKKG-UHFFFAOYSA-N
Compound name
2-(cyclohexylideneamino)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

3
Patents

154.12184 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.12912 132.2
[M+Na]+ 177.11106 135.3
[M-H]- 153.11456 136.6
[M+NH4]+ 172.15566 152.3
[M+K]+ 193.08500 134.9
[M+H-H2O]+ 137.11910 125.0
[M+HCOO]- 199.12004 158.2
[M+CH3COO]- 213.13569 187.9
[M+Na-2H]- 175.09651 137.3
[M]+ 154.12129 123.6
[M]- 154.12239 123.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe