CID 163309

Tefazoline

Structural Information

Molecular Formula
C14H18N2
SMILES
C1CCC2=C(C1)C=CC=C2CC3=NCCN3
InChI
InChI=1S/C14H18N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h3,5-6H,1-2,4,7-10H2,(H,15,16)
InChIKey
RSTAWBICYZRXME-UHFFFAOYSA-N
Compound name
2-(5,6,7,8-tetrahydronaphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

111
Patents

214.147 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.15428 149.8
[M+Na]+ 237.13622 155.2
[M-H]- 213.13972 152.2
[M+NH4]+ 232.18082 167.3
[M+K]+ 253.11016 150.1
[M+H-H2O]+ 197.14426 141.2
[M+HCOO]- 259.14520 166.3
[M+CH3COO]- 273.16085 160.4
[M+Na-2H]- 235.12167 153.8
[M]+ 214.14645 143.6
[M]- 214.14755 143.6
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