CID 6912279

Un2crh8iyr

Structural Information

Molecular Formula
C10H13N3
SMILES
C1=CC=C(C=C1)/C=C\CN=C(N)N
InChI
InChI=1S/C10H13N3/c11-10(12)13-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H4,11,12,13)/b7-4-
InChIKey
PVTRCZCFBBXXQG-DAXSKMNVSA-N
Compound name
2-[(Z)-3-phenylprop-2-enyl]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

175.11095 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.118226 138.8
[M+Na]+ 198.100168 144.1
[M-H]- 174.103674 142.5
[M+NH4]+ 193.144773 158.1
[M+K]+ 214.074108 141.4
[M+H-H2O]+ 158.108210 131.8
[M+HCOO]- 220.109151 165.8
[M+CH3COO]- 234.124801 188.2
[M+Na-2H]- 196.085616 144.5
[M]+ 175.11040142 134.5
[M]- 175.11149858 134.5
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.