CID 13404588

2-oxa-6-azaspiro(3.3)heptane, 6-cyclohexyl-

Structural Information

Molecular Formula
C11H19NO
SMILES
C1CCC(CC1)N2CC3(C2)COC3
InChI
InChI=1S/C11H19NO/c1-2-4-10(5-3-1)12-6-11(7-12)8-13-9-11/h10H,1-9H2
InChIKey
MIJJZZQSMUOVHO-UHFFFAOYSA-N
Compound name
6-cyclohexyl-2-oxa-6-azaspiro[3.3]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

181.14667 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.153946 124.7
[M+Na]+ 204.135888 127.2
[M-H]- 180.139394 131.1
[M+NH4]+ 199.180493 130.9
[M+K]+ 220.109828 132.6
[M+H-H2O]+ 164.143930 110.2
[M+HCOO]- 226.144871 138.8
[M+CH3COO]- 240.160521 192.2
[M+Na-2H]- 202.121336 131.4
[M]+ 181.14612142 136.0
[M]- 181.14721858 136.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe