CID 511811

2-(1-adamantyl)pyrrolidine

Structural Information

Molecular Formula
C14H23N
SMILES
C1CC(NC1)C23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C14H23N/c1-2-13(15-3-1)14-7-10-4-11(8-14)6-12(5-10)9-14/h10-13,15H,1-9H2
InChIKey
YVRRAISBZUMEJB-UHFFFAOYSA-N
Compound name
2-(1-adamantyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

63
Patents

205.18304 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 146.6
[M+Na]+ 228.17226 147.4
[M-H]- 204.17576 141.9
[M+NH4]+ 223.21686 171.8
[M+K]+ 244.14620 142.3
[M+H-H2O]+ 188.18030 139.1
[M+HCOO]- 250.18124 150.4
[M+CH3COO]- 264.19689 154.3
[M+Na-2H]- 226.15771 153.5
[M]+ 205.18249 140.9
[M]- 205.18359 140.9
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.