CID 125180924

2172270-22-1

Structural Information

Molecular Formula
C9H15NO
SMILES
C1CC2(C1)CN[C@H]3[C@@H]2COC3
InChI
InChI=1S/C9H15NO/c1-2-9(3-1)6-10-8-5-11-4-7(8)9/h7-8,10H,1-6H2/t7-,8+/m0/s1
InChIKey
HSHQTJIPOQZBLR-JGVFFNPUSA-N
Compound name
(3aR,6aS)-spiro[1,2,3a,4,6,6a-hexahydrofuro[3,4-b]pyrrole-3,1'-cyclobutane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.12265 131.4
[M+Na]+ 176.10459 135.5
[M+NH4]+ 171.14919 138.3
[M+K]+ 192.07853 134.1
[M-H]- 152.10809 131.2
[M+Na-2H]- 174.09004 132.7
[M]+ 153.11482 130.6
[M]- 153.11592 130.6
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.