CID 13697

N-nitrosodicyclohexylamine

Structural Information

Molecular Formula
C12H22N2O
SMILES
C1CCC(CC1)N(C2CCCCC2)N=O
InChI
InChI=1S/C12H22N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKey
CYMNKXLBEMEABS-UHFFFAOYSA-N
Compound name
N,N-dicyclohexylnitrous amide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

4
References

65
Patents

210.17322 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.18050 148.8
[M+Na]+ 233.16244 148.9
[M-H]- 209.16594 155.8
[M+NH4]+ 228.20704 167.0
[M+K]+ 249.13638 149.0
[M+H-H2O]+ 193.17048 140.4
[M+HCOO]- 255.17142 169.5
[M+CH3COO]- 269.18707 195.2
[M+Na-2H]- 231.14789 152.2
[M]+ 210.17267 140.9
[M]- 210.17377 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

literature stripe

Patent stripe

patents stripe