CID 69744117

3,8,8-trimethyl-5,6,7,8-tetrahydronaphthalen-2-amine

Structural Information

Molecular Formula
C13H19N
SMILES
CC1=CC2=C(C=C1N)C(CCC2)(C)C
InChI
InChI=1S/C13H19N/c1-9-7-10-5-4-6-13(2,3)11(10)8-12(9)14/h7-8H,4-6,14H2,1-3H3
InChIKey
PQKSLGHTTZKFMD-UHFFFAOYSA-N
Compound name
3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

189.15175 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 142.8
[M+Na]+ 212.14097 156.0
[M+NH4]+ 207.18557 154.6
[M+K]+ 228.11491 146.3
[M-H]- 188.14447 147.3
[M+Na-2H]- 210.12642 150.6
[M]+ 189.15120 146.2
[M]- 189.15230 146.2
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