CID 20006

Dimethylamphetamine

Structural Information

Molecular Formula
C11H17N
SMILES
CC(CC1=CC=CC=C1)N(C)C
InChI
InChI=1S/C11H17N/c1-10(12(2)3)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3
InChIKey
OBDSVYOSYSKVMX-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-phenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

41
References

587
Patents

163.1361 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.143376 137.6
[M+Na]+ 186.125318 143.2
[M-H]- 162.128824 142.3
[M+NH4]+ 181.169923 158.7
[M+K]+ 202.099258 142.7
[M+H-H2O]+ 146.133360 131.3
[M+HCOO]- 208.134301 162.1
[M+CH3COO]- 222.149951 186.7
[M+Na-2H]- 184.110766 143.1
[M]+ 163.13555142 138.1
[M]- 163.13664858 138.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe