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]+ 214.097486 143.8
[M+Na]+ 236.079428 152.1
[M-H]- 212.082934 146.2
[M+NH4]+ 231.124033 161.5
[M+K]+ 252.053368 147.7
[M+H-H2O]+ 196.087470 135.3
[M+HCOO]- 258.088411 163.0
[M+CH3COO]- 272.104061 155.8
[M+Na-2H]- 234.064876 154.0
[M]+ 213.08966142 141.2
[M]- 213.09075858 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.