CID 6480612

N,1-bis(2-adamantyl)pyrrolidin-3-amine

Structural Information

Molecular Formula
C24H38N2
SMILES
C1CN(CC1NC2C3CC4CC(C3)CC2C4)C5C6CC7CC(C6)CC5C7
InChI
InChI=1S/C24H38N2/c1-2-26(24-20-9-16-4-17(11-20)12-21(24)10-16)13-22(1)25-23-18-5-14-3-15(7-18)8-19(23)6-14/h14-25H,1-13H2
InChIKey
ZRHMAHYRXJCZBY-UHFFFAOYSA-N
Compound name
N,1-bis(2-adamantyl)pyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.3035 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.31078 159.3
[M+Na]+ 377.29272 149.0
[M-H]- 353.29622 149.5
[M+NH4]+ 372.33732 177.1
[M+K]+ 393.26666 142.9
[M+H-H2O]+ 337.30076 146.1
[M+HCOO]- 399.30170 147.2
[M+CH3COO]- 413.31735 158.9
[M+Na-2H]- 375.27817 161.4
[M]+ 354.30295 151.0
[M]- 354.30405 151.0
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.