CID 368426

Nsc639442

Structural Information

Molecular Formula
C16H26N2O2
SMILES
CN1CC(C(C1)O)C(=O)NC23CC4CC(C2)CC(C4)C3
InChI
InChI=1S/C16H26N2O2/c1-18-8-13(14(19)9-18)15(20)17-16-5-10-2-11(6-16)4-12(3-10)7-16/h10-14,19H,2-9H2,1H3,(H,17,20)
InChIKey
SYDKEOBBTPWYAT-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)-4-hydroxy-1-methylpyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.19943 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.20671 163.3
[M+Na]+ 301.18865 163.7
[M-H]- 277.19215 158.3
[M+NH4]+ 296.23325 185.6
[M+K]+ 317.16259 159.8
[M+H-H2O]+ 261.19669 156.6
[M+HCOO]- 323.19763 166.4
[M+CH3COO]- 337.21328 169.8
[M+Na-2H]- 299.17410 168.4
[M]+ 278.19888 160.0
[M]- 278.19998 160.0
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.