CID 16671

5,6,7,8-tetrahydro-1-naphthylamine

Structural Information

Molecular Formula
C10H13N
SMILES
C1CCC2=C(C1)C=CC=C2N
InChI
InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7H,1-2,4,6,11H2
InChIKey
SODWJACROGQSMM-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydronaphthalen-1-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5703
Patents

147.1048 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11208 129.1
[M+Na]+ 170.09402 135.6
[M-H]- 146.09752 132.8
[M+NH4]+ 165.13862 151.0
[M+K]+ 186.06796 132.6
[M+H-H2O]+ 130.10206 123.4
[M+HCOO]- 192.10300 150.8
[M+CH3COO]- 206.11865 142.3
[M+Na-2H]- 168.07947 136.7
[M]+ 147.10425 123.9
[M]- 147.10535 123.9
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