CID 131583352

1-{3-oxaspiro[5.5]undecan-9-yl}methanamine hydrochloride

Structural Information

Molecular Formula
C11H21NO
SMILES
C1CC2(CCC1CN)CCOCC2
InChI
InChI=1S/C11H21NO/c12-9-10-1-3-11(4-2-10)5-7-13-8-6-11/h10H,1-9,12H2
InChIKey
ZSZXDJXZSZNBGE-UHFFFAOYSA-N
Compound name
3-oxaspiro[5.5]undecan-9-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.16231 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.16959 143.3
[M+Na]+ 206.15153 145.8
[M-H]- 182.15503 147.5
[M+NH4]+ 201.19613 163.0
[M+K]+ 222.12547 145.0
[M+H-H2O]+ 166.15957 136.9
[M+HCOO]- 228.16051 159.6
[M+CH3COO]- 242.17616 181.2
[M+Na-2H]- 204.13698 148.7
[M]+ 183.16176 134.0
[M]- 183.16286 134.0
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.