CID 118997490

Tert-butyl n-{7-aminospiro[3.5]nonan-2-yl}carbamate hydrochloride

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)NC1CC2(C1)CCC(CC2)N
InChI
InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)16-11-8-14(9-11)6-4-10(15)5-7-14/h10-11H,4-9,15H2,1-3H3,(H,16,17)
InChIKey
CCEGXOJKJCOJFW-UHFFFAOYSA-N
Compound name
tert-butyl N-(7-aminospiro[3.5]nonan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

254.19943 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.20671 163.6
[M+Na]+ 277.18865 165.0
[M-H]- 253.19215 167.4
[M+NH4]+ 272.23325 175.5
[M+K]+ 293.16259 167.0
[M+H-H2O]+ 237.19669 152.6
[M+HCOO]- 299.19763 179.5
[M+CH3COO]- 313.21328 201.3
[M+Na-2H]- 275.17410 165.7
[M]+ 254.19888 166.5
[M]- 254.19998 166.5
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

patents stripe