CID 155820831

(2-amino-5-methylphenyl)dimethylphosphine oxide

Structural Information

Molecular Formula
C9H14NOP
SMILES
CC1=CC(=C(C=C1)N)P(=O)(C)C
InChI
InChI=1S/C9H14NOP/c1-7-4-5-8(10)9(6-7)12(2,3)11/h4-6H,10H2,1-3H3
InChIKey
RVKDPIRKOIFKBO-UHFFFAOYSA-N
Compound name
2-dimethylphosphoryl-4-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

183.0813 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.088576 141.4
[M+Na]+ 206.070518 150.0
[M-H]- 182.074024 144.1
[M+NH4]+ 201.115123 162.0
[M+K]+ 222.044458 147.9
[M+H-H2O]+ 166.078560 134.1
[M+HCOO]- 228.079501 170.3
[M+CH3COO]- 242.095151 186.2
[M+Na-2H]- 204.055966 144.1
[M]+ 183.08075142 142.0
[M]- 183.08184858 142.0
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

patents stripe