CID 3045785

Brn 2838271

Structural Information

Molecular Formula
C11H18AsNO
SMILES
CC[As](C1=CC=CC=C1OC)N(C)C
InChI
InChI=1S/C11H18AsNO/c1-5-12(13(2)3)10-8-6-7-9-11(10)14-4/h6-9H,5H2,1-4H3
InChIKey
HPPQLFVCYCKXEH-UHFFFAOYSA-N
Compound name
N-[ethyl-(2-methoxyphenyl)arsanyl]-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.06044 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.06772 156.6
[M+Na]+ 278.04966 162.2
[M-H]- 254.05316 161.0
[M+NH4]+ 273.09426 176.1
[M+K]+ 294.02360 161.7
[M+H-H2O]+ 238.05770 149.4
[M+HCOO]- 300.05864 180.3
[M+CH3COO]- 314.07429 194.9
[M+Na-2H]- 276.03511 159.5
[M]+ 255.05989 159.3
[M]- 255.06099 159.3
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.