CID 22637

5-diethylamino-2-nitroso-4-methylphenol

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CCN(CC)C1=CC(=C(C=C1C)N=O)O
InChI
InChI=1S/C11H16N2O2/c1-4-13(5-2)10-7-11(14)9(12-15)6-8(10)3/h6-7,14H,4-5H2,1-3H3
InChIKey
MNDVZPIGIFDSFC-UHFFFAOYSA-N
Compound name
5-(diethylamino)-4-methyl-2-nitrosophenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

208.12119 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 145.3
[M+Na]+ 231.11041 153.3
[M-H]- 207.11391 151.0
[M+NH4]+ 226.15501 165.0
[M+K]+ 247.08435 152.7
[M+H-H2O]+ 191.11845 138.7
[M+HCOO]- 253.11939 172.4
[M+CH3COO]- 267.13504 197.3
[M+Na-2H]- 229.09586 150.2
[M]+ 208.12064 149.0
[M]- 208.12174 149.0
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