CID 32536

(+-)-endo-n-(2,4-dimethylbenzyl)-2-bornanamine hydrochloride

Structural Information

Molecular Formula
C19H29N
SMILES
CC1=CC(=C(C=C1)CNC2CC3CCC2(C3(C)C)C)C
InChI
InChI=1S/C19H29N/c1-13-6-7-15(14(2)10-13)12-20-17-11-16-8-9-19(17,5)18(16,3)4/h6-7,10,16-17,20H,8-9,11-12H2,1-5H3
InChIKey
CRPYGWGYNPTJPD-UHFFFAOYSA-N
Compound name
N-[(2,4-dimethylphenyl)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.23 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.23728 166.4
[M+Na]+ 294.21922 174.5
[M-H]- 270.22272 172.9
[M+NH4]+ 289.26382 192.5
[M+K]+ 310.19316 169.3
[M+H-H2O]+ 254.22726 161.6
[M+HCOO]- 316.22820 187.0
[M+CH3COO]- 330.24385 205.5
[M+Na-2H]- 292.20467 167.8
[M]+ 271.22945 166.7
[M]- 271.23055 166.7
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.