CID 137935870

2490420-58-9

Structural Information

Molecular Formula
C9H15NO
SMILES
CC12CC(C1)(C3(O2)CCC3)N
InChI
InChI=1S/C9H15NO/c1-7-5-8(10,6-7)9(11-7)3-2-4-9/h2-6,10H2,1H3
InChIKey
IIAXUDMXDNBPTN-UHFFFAOYSA-N
Compound name
1-methylspiro[2-oxabicyclo[2.1.1]hexane-3,1'-cyclobutane]-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.122646 141.0
[M+Na]+ 176.104588 146.1
[M-H]- 152.108094 146.1
[M+NH4]+ 171.149193 158.7
[M+K]+ 192.078528 149.2
[M+H-H2O]+ 136.112630 132.6
[M+HCOO]- 198.113571 156.4
[M+CH3COO]- 212.129221 152.7
[M+Na-2H]- 174.090036 149.1
[M]+ 153.11482142 159.1
[M]- 153.11591858 159.1
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.