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

4
Patents

181.14667 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.15395 124.7
[M+Na]+ 204.13589 127.2
[M-H]- 180.13939 131.1
[M+NH4]+ 199.18049 130.9
[M+K]+ 220.10983 132.6
[M+H-H2O]+ 164.14393 110.2
[M+HCOO]- 226.14487 138.8
[M+CH3COO]- 240.16052 192.2
[M+Na-2H]- 202.12134 131.4
[M]+ 181.14612 136.0
[M]- 181.14722 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