CID 26640

14352-87-5

Structural Information

Molecular Formula
C12H20N
SMILES
CC(CC1=CC=CC=C1)[N+](C)(C)C
InChI
InChI=1S/C12H20N/c1-11(13(2,3)4)10-12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3/q+1
InChIKey
CIOAZSKKJMOUJW-UHFFFAOYSA-N
Compound name
trimethyl(1-phenylpropan-2-yl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

178.15958 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.16686 139.4
[M+Na]+ 201.14880 145.2
[M-H]- 177.15230 144.4
[M+NH4]+ 196.19340 160.0
[M+K]+ 217.12274 138.8
[M+H-H2O]+ 161.15684 136.5
[M+HCOO]- 223.15778 162.5
[M+CH3COO]- 237.17343 182.7
[M+Na-2H]- 199.13425 148.6
[M]+ 178.15903 138.8
[M]- 178.16013 138.8
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