CID 165941412

2680662-11-5

Structural Information

Molecular Formula
C16H24N2O3
SMILES
CN(CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O)N=O
InChI
InChI=1S/C16H24N2O3/c1-18(17-20)12-15(16(19)10-4-3-5-11-16)13-6-8-14(21-2)9-7-13/h6-9,15,19H,3-5,10-12H2,1-2H3
InChIKey
ZSUCJRRVTCFTNC-UHFFFAOYSA-N
Compound name
N-[2-(1-hydroxycyclohexyl)-2-(4-methoxyphenyl)ethyl]-N-methylnitrous amide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.17868 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.185956 168.5
[M+Na]+ 315.167898 171.1
[M-H]- 291.171404 175.3
[M+NH4]+ 310.212503 185.1
[M+K]+ 331.141838 170.8
[M+H-H2O]+ 275.175940 160.4
[M+HCOO]- 337.176881 190.2
[M+CH3COO]- 351.192531 209.3
[M+Na-2H]- 313.153346 171.9
[M]+ 292.17813142 167.5
[M]- 292.17922858 167.5
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.