CID 135721478

42272-79-7

Structural Information

Molecular Formula
C12H11N3O
SMILES
C1CC2=NC3=CC=CC=C3N=C2/C(=N/O)/C1
InChI
InChI=1S/C12H11N3O/c16-15-11-7-3-6-10-12(11)14-9-5-2-1-4-8(9)13-10/h1-2,4-5,16H,3,6-7H2/b15-11+
InChIKey
VTRYAOQPGFWWRM-RVDMUPIBSA-N
Compound name
(NE)-N-(3,4-dihydro-2H-phenazin-1-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.09021 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.09749 143.8
[M+Na]+ 236.07943 152.1
[M-H]- 212.08293 146.2
[M+NH4]+ 231.12403 161.5
[M+K]+ 252.05337 147.7
[M+H-H2O]+ 196.08747 135.3
[M+HCOO]- 258.08841 163.0
[M+CH3COO]- 272.10406 155.8
[M+Na-2H]- 234.06488 154.0
[M]+ 213.08966 141.2
[M]- 213.09076 141.2
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.