CID 126970883

1-(propan-2-yl)-2-azaspiro[3.6]decane

Structural Information

Molecular Formula
C12H23N
SMILES
CC(C)C1C2(CCCCCC2)CN1
InChI
InChI=1S/C12H23N/c1-10(2)11-12(9-13-11)7-5-3-4-6-8-12/h10-11,13H,3-9H2,1-2H3
InChIKey
BPISNDDDCUHALG-UHFFFAOYSA-N
Compound name
3-propan-2-yl-2-azaspiro[3.6]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.18304 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.190316 142.8
[M+Na]+ 204.172258 144.1
[M-H]- 180.175764 145.7
[M+NH4]+ 199.216863 155.4
[M+K]+ 220.146198 146.7
[M+H-H2O]+ 164.180300 133.4
[M+HCOO]- 226.181241 156.2
[M+CH3COO]- 240.196891 185.6
[M+Na-2H]- 202.157706 145.6
[M]+ 181.18249142 141.2
[M]- 181.18358858 141.2
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.