CID 64473

2,5-methanoindan-4-amine, hexahydro-4-phenethyl-, hydrochloride

Structural Information

Molecular Formula
C18H25N
SMILES
C1CC2CC3CC1C(C3)C2(CCC4=CC=CC=C4)N
InChI
InChI=1S/C18H25N/c19-18(9-8-13-4-2-1-3-5-13)16-7-6-15-10-14(11-16)12-17(15)18/h1-5,14-17H,6-12,19H2
InChIKey
AFCISHPGTHIZJQ-UHFFFAOYSA-N
Compound name
7-(2-phenylethyl)tricyclo[4.3.1.03,8]decan-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.1987 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.205976 161.6
[M+Na]+ 278.187918 165.7
[M-H]- 254.191424 164.4
[M+NH4]+ 273.232523 184.8
[M+K]+ 294.161858 159.9
[M+H-H2O]+ 238.195960 154.5
[M+HCOO]- 300.196901 176.1
[M+CH3COO]- 314.212551 171.5
[M+Na-2H]- 276.173366 165.7
[M]+ 255.19815142 156.6
[M]- 255.19924858 156.6
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

No patent data available for this compound.