CID 67115

N,n-diethyl-4-nitrosoaniline

Structural Information

Molecular Formula
C10H14N2O
SMILES
CCN(CC)C1=CC=C(C=C1)N=O
InChI
InChI=1S/C10H14N2O/c1-3-12(4-2)10-7-5-9(11-13)6-8-10/h5-8H,3-4H2,1-2H3
InChIKey
OLNMJIHADFYHAK-UHFFFAOYSA-N
Compound name
N,N-diethyl-4-nitrosoaniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

7
References

436
Patents

178.11061 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 137.8
[M+Na]+ 201.09983 144.8
[M-H]- 177.10333 144.4
[M+NH4]+ 196.14443 158.8
[M+K]+ 217.07377 144.9
[M+H-H2O]+ 161.10787 130.9
[M+HCOO]- 223.10881 166.5
[M+CH3COO]- 237.12446 192.5
[M+Na-2H]- 199.08528 145.1
[M]+ 178.11006 140.9
[M]- 178.11116 140.9
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.