CID 43810852

1172268-86-8

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)NC1CC2CCCC(C1)C2N
InChI
InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-11-7-9-5-4-6-10(8-11)12(9)15/h9-12H,4-8,15H2,1-3H3,(H,16,17)
InChIKey
IRRTYOSSILIGST-UHFFFAOYSA-N
Compound name
tert-butyl N-(9-amino-3-bicyclo[3.3.1]nonanyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.19943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.20671 161.3
[M+Na]+ 277.18865 163.9
[M-H]- 253.19215 162.2
[M+NH4]+ 272.23325 179.3
[M+K]+ 293.16259 162.2
[M+H-H2O]+ 237.19669 155.8
[M+HCOO]- 299.19763 175.9
[M+CH3COO]- 313.21328 201.1
[M+Na-2H]- 275.17410 164.3
[M]+ 254.19888 155.7
[M]- 254.19998 155.7
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.