CID 5273857

1,2,3,4-tetrahydrobenzo[b]phenazine

Structural Information

Molecular Formula
C16H14N2
SMILES
C1CCC2=NC3=CC4=CC=CC=C4C=C3N=C2C1
InChI
InChI=1S/C16H14N2/c1-2-6-12-10-16-15(9-11(12)5-1)17-13-7-3-4-8-14(13)18-16/h1-2,5-6,9-10H,3-4,7-8H2
InChIKey
CXOADDVHIXHDIJ-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydrobenzo[b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

234.11569 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.12297 150.6
[M+Na]+ 257.10491 159.8
[M-H]- 233.10841 153.8
[M+NH4]+ 252.14951 168.5
[M+K]+ 273.07885 153.4
[M+H-H2O]+ 217.11295 141.0
[M+HCOO]- 279.11389 167.9
[M+CH3COO]- 293.12954 162.3
[M+Na-2H]- 255.09036 161.7
[M]+ 234.11514 149.1
[M]- 234.11624 149.1
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.