CID 154382820

[1-(2-methoxyphenyl)propan-2-yl](methyl)nitrosoamine

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CC(CC1=CC=CC=C1OC)N(C)N=O
InChI
InChI=1S/C11H16N2O2/c1-9(13(2)12-14)8-10-6-4-5-7-11(10)15-3/h4-7,9H,8H2,1-3H3
InChIKey
ICXPUSTZVNISLH-UHFFFAOYSA-N
Compound name
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylnitrous amide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 146.1
[M+Na]+ 231.11041 152.3
[M-H]- 207.11391 152.5
[M+NH4]+ 226.15501 165.7
[M+K]+ 247.08435 153.1
[M+H-H2O]+ 191.11845 138.8
[M+HCOO]- 253.11939 173.7
[M+CH3COO]- 267.13504 198.4
[M+Na-2H]- 229.09586 151.6
[M]+ 208.12064 150.3
[M]- 208.12174 150.3
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.