CID 46475

N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

Structural Information

Molecular Formula
C11H15N
SMILES
CNC1CCCC2=CC=CC=C12
InChI
InChI=1S/C11H15N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2-3,5,7,11-12H,4,6,8H2,1H3
InChIKey
JQEUPNKUYMHYPW-UHFFFAOYSA-N
Compound name
N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

561
Patents

161.12045 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.12773 133.1
[M+Na]+ 184.10967 139.1
[M-H]- 160.11317 137.1
[M+NH4]+ 179.15427 154.7
[M+K]+ 200.08361 136.3
[M+H-H2O]+ 144.11771 127.1
[M+HCOO]- 206.11865 155.1
[M+CH3COO]- 220.13430 181.4
[M+Na-2H]- 182.09512 141.2
[M]+ 161.11990 129.2
[M]- 161.12100 129.2
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