CID 217681

2-phenyl-1-oxa-4-azaspiro(4.5)decane monohydrochloride

Structural Information

Molecular Formula
C14H19NO
SMILES
C1CCC2(CC1)NCC(O2)C3=CC=CC=C3
InChI
InChI=1S/C14H19NO/c1-3-7-12(8-4-1)13-11-15-14(16-13)9-5-2-6-10-14/h1,3-4,7-8,13,15H,2,5-6,9-11H2
InChIKey
LERXFNHFZBNDFM-UHFFFAOYSA-N
Compound name
2-phenyl-1-oxa-4-azaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.14667 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.15395 150.7
[M+Na]+ 240.13589 154.9
[M-H]- 216.13939 156.2
[M+NH4]+ 235.18049 169.1
[M+K]+ 256.10983 151.9
[M+H-H2O]+ 200.14393 142.9
[M+HCOO]- 262.14487 166.6
[M+CH3COO]- 276.16052 161.5
[M+Na-2H]- 238.12134 155.0
[M]+ 217.14612 142.5
[M]- 217.14722 142.5
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.