CID 107260

N-methyl-1-(2-nitrophenyl)propan-2-amine

Structural Information

Molecular Formula
C10H14N2O2
SMILES
CC(CC1=CC=CC=C1[N+](=O)[O-])NC
InChI
InChI=1S/C10H14N2O2/c1-8(11-2)7-9-5-3-4-6-10(9)12(13)14/h3-6,8,11H,7H2,1-2H3
InChIKey
GPGIHKMMXVEDQK-UHFFFAOYSA-N
Compound name
N-methyl-1-(2-nitrophenyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10553 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 141.5
[M+Na]+ 217.09475 147.2
[M-H]- 193.09825 145.2
[M+NH4]+ 212.13935 159.9
[M+K]+ 233.06869 141.7
[M+H-H2O]+ 177.10279 139.9
[M+HCOO]- 239.10373 167.0
[M+CH3COO]- 253.11938 182.3
[M+Na-2H]- 215.08020 148.3
[M]+ 194.10498 139.7
[M]- 194.10608 139.7
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.