CID 82665290

Tert-butyl n-({1-azaspiro[4.4]nonan-7-yl}methyl)carbamate

Structural Information

Molecular Formula
C14H26N2O2
SMILES
CC(C)(C)OC(=O)NCC1CCC2(C1)CCCN2
InChI
InChI=1S/C14H26N2O2/c1-13(2,3)18-12(17)15-10-11-5-7-14(9-11)6-4-8-16-14/h11,16H,4-10H2,1-3H3,(H,15,17)
InChIKey
GGFJAHKIDASGNU-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-azaspiro[4.4]nonan-8-ylmethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.19943 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.206706 164.8
[M+Na]+ 277.188648 167.9
[M-H]- 253.192154 166.8
[M+NH4]+ 272.233253 185.1
[M+K]+ 293.162588 165.8
[M+H-H2O]+ 237.196690 159.2
[M+HCOO]- 299.197631 181.1
[M+CH3COO]- 313.213281 190.9
[M+Na-2H]- 275.174096 165.7
[M]+ 254.19888142 159.5
[M]- 254.19997858 159.5
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

No patent data available for this compound.